data_1tz1_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 1tz1 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.507 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 1.1 mt . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.742 0.306 . . . . 1.75 110.927 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.713 ' HB2' ' HB ' ' A' ' 851' ' ' ILE . 0.7 OUTLIER -143.39 84.72 1.82 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.268 -0.423 . . . . 1.3600000000000001 110.366 179.735 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.584 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -98.0 103.28 15.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.905 -0.589 . . . . 1.1899999999999999 110.6 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . 0.552 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.1 OUTLIER -112.56 -166.44 1.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.626 -0.715 . . . . 2.1499999999999999 110.732 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.79 112.06 19.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.056 -0.52 . . . . 1.53 110.035 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 10.1 m -103.67 157.1 5.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.998 -0.546 . . . . 1.79 111.138 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.591 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 4.1 tp10 -102.8 170.45 7.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 1.3999999999999999 110.978 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . 0.591 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.4 OUTLIER -83.65 27.04 0.64 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 3.3399999999999999 110.6 179.752 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -136.58 -25.44 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.932 -0.576 . . . . 1.0900000000000001 110.57 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -52.6 123.15 10.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.702 -0.681 . . . . 0.34000000000000002 111.939 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.98 166.03 12.9 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.733 -0.84 . . . . 1.8899999999999999 108.733 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.478 ' O ' HG12 ' A' ' 795' ' ' ILE . 93.0 t80 -52.71 -28.46 22.05 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.693 -0.403 . . . . 0.73999999999999999 110.165 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.47 ' O ' ' HG3' ' A' ' 796' ' ' MET . 14.6 t70 -68.75 -56.24 8.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.07 -0.514 . . . . 2.0499999999999998 109.702 178.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . 0.509 ' HA ' ' HG3' ' A' ' 796' ' ' MET . 1.2 t0 -57.44 -33.05 67.52 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.969 -0.56 . . . . 1.0700000000000001 110.232 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.51 HD13 ' CZ2' ' A' ' 834' ' ' TRP . 30.5 tp -63.69 -53.16 55.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.864 -0.607 . . . . 1.55 109.91 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.649 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 35.8 mm -56.62 -27.01 24.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.645 -0.707 . . . . 1.0800000000000001 111.23 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.509 ' HG3' ' HA ' ' A' ' 793' ' ' ASP . 10.5 mtp -67.66 -46.95 70.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.724 0.297 . . . . 2.21 110.458 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . 0.425 ' O ' ' HD3' ' A' ' 801' ' ' LYS . . . -56.87 -53.68 55.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.037 0.446 . . . . 1.0900000000000001 109.935 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.41 HG21 HD11 ' A' ' 813' ' ' ILE . 75.4 mt -57.95 -51.44 70.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.746 -0.661 . . . . 1.1799999999999999 110.616 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.649 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t-20 -56.27 -26.96 53.65 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.519 -0.764 . . . . 1.2 111.325 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.11 -23.47 41.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.317 -0.401 . . . . 1.52 110.614 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . 0.425 ' HD3' ' O ' ' A' ' 797' ' ' ALA . 0.5 OUTLIER -101.08 -1.67 33.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.952 -0.567 . . . . 2.73 111.179 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.756 HD11 HG12 ' A' ' 813' ' ' ILE . 1.4 pp -117.14 -29.42 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.453 -0.34 . . . . 1.4099999999999999 111.349 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.408 ' N ' HG13 ' A' ' 802' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.283 -0.417 . . . . 2.0099999999999998 110.871 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 C--O 1.232 0.202 0 CA-C-O 120.772 0.239 . . . . 1.3799999999999999 112.486 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.756 HG12 HD11 ' A' ' 802' ' ' ILE . 4.4 pt -145.05 171.87 5.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.122 -0.49 . . . . 2.4399999999999999 110.931 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 3.2 p -144.57 -53.81 0.32 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.319 -0.401 . . . . 1.73 111.271 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -81.98 114.92 20.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 3.1299999999999999 110.767 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.08 169.27 20.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.232 -0.44 . . . . 1.52 111.318 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . 0.445 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 8.9 mttt -110.58 166.68 10.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.025 -0.534 . . . . 1.4299999999999999 110.421 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.592 ' HB2' HD12 ' A' ' 849' ' ' LEU . 10.6 p90 -149.77 152.94 36.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.973 0.416 . . . . 1.24 111.377 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.74 108.01 9.45 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.933 -0.576 . . . . 2.0899999999999999 110.672 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.841 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.0 t70 -78.97 179.3 7.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.383 -0.826 . . . . 1.8 110.792 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.71 35.96 0.53 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 1.6200000000000001 111.051 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.33 16.27 3.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.32 -0.4 . . . . 1.6499999999999999 110.999 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 60.98 46.45 94.55 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.787 -0.721 . . . . 0.88 112.319 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -174.02 134.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.972 0.415 . . . . 1.8600000000000001 110.65 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.411 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 72.5 m-85 -65.7 144.97 56.58 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.944 -0.571 . . . . 0.80000000000000004 110.766 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.841 HG22 ' HB2' ' A' ' 820' ' ' ASP . 1.0 OUTLIER -130.03 179.56 4.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 1.73 110.903 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.7 113.57 33.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.981 0.42 . . . . 1.21 111.397 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.97 131.5 34.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.804 -0.634 . . . . 1.52 110.725 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -76.76 -68.52 1.51 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.723 -0.751 . . . . 1.0900000000000001 112.669 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 90.7 p -170.17 -137.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.38 -0.23 . . . . 1.8 110.38 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -54.45 -27.93 40.81 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.907 0.384 . . . . 2.2000000000000002 110.65 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.92 -68.41 0.35 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.08 -0.509 . . . . 2.21 110.882 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' A' ' 837' ' ' ALA . 0.6 OUTLIER -64.1 -11.28 28.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.3 -0.409 . . . . 0.72999999999999998 110.674 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.51 ' CZ2' HD13 ' A' ' 794' ' ' LEU . 1.5 t-105 -82.86 -41.65 18.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.29999999999999999 110.176 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 54.9 m-20 -73.42 -27.33 61.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.048 -0.524 . . . . 2.8500000000000001 110.001 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 51.0 t -78.84 -51.42 17.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.771 -0.65 . . . . 1.4399999999999999 109.928 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.457 ' HB2' ' O ' ' A' ' 833' ' ' ASP . . . -58.13 -30.45 66.34 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.991 -0.55 . . . . 1.04 110.314 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.45 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 1.7 mtpp -67.16 -49.34 65.09 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.877 -0.602 . . . . 1.3600000000000001 110.467 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.88 -24.77 66.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 1.95 110.334 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.9 ttp -75.56 -34.05 60.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.84 -0.618 . . . . 1.0900000000000001 110.37 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 27.8 mt -69.98 -47.42 62.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.915 -0.584 . . . . 1.1799999999999999 110.803 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.45 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.53 -3.64 44.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 1.1799999999999999 111.404 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -3.49 2.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.971 0.415 . . . . 1.6799999999999999 110.171 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.45 ' H ' ' C ' ' A' ' 842' ' ' ALA . 1.5 m120 -145.35 -73.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.771 -0.649 . . . . 1.96 110.322 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -179.26 27.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.833 -0.622 . . . . 2.4700000000000002 110.921 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.22 142.96 30.98 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.291 -0.413 . . . . 2.2999999999999998 110.913 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -132.91 -16.65 2.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.947 -0.569 . . . . 2.46 110.698 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.552 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 32.7 m-85 -84.46 144.9 28.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.171 -0.468 . . . . 1.52 111.133 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.592 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.5 OUTLIER -124.42 131.19 53.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.935 -0.575 . . . . 1.3799999999999999 110.516 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.462 ' C ' HG12 ' A' ' 851' ' ' ILE . 10.5 m120 -89.87 153.58 20.53 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.885 -0.598 . . . . 1.5600000000000001 111.185 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.713 ' HB ' ' HB2' ' A' ' 781' ' ' PHE . 1.5 mm . . . . . 0 C--N 1.333 -0.15 0 CA-C-N 116.123 -0.49 . . . . 1.73 111.413 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.756 0.312 . . . . 1.75 110.949 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.611 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.3 OUTLIER -153.77 92.05 1.52 Allowed 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.053 0.454 . . . . 1.3600000000000001 110.006 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.552 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -97.43 97.93 9.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.736 -0.666 . . . . 1.1899999999999999 110.89 -179.349 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . 0.529 HD13 ' HZ3' ' A' ' 801' ' ' LYS . 0.5 OUTLIER -91.56 146.73 23.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.595 -0.73 . . . . 2.1499999999999999 111.086 -179.671 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.78 108.98 12.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.404 . . . . 1.53 110.555 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.411 HG12 ' CH2' ' A' ' 834' ' ' TRP . 17.3 m -98.48 -166.6 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.898 -0.592 . . . . 1.79 111.371 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.497 ' HG2' HG12 ' A' ' 788' ' ' VAL . 0.8 OUTLIER -140.37 171.55 13.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.278 -0.419 . . . . 1.3999999999999999 111.003 -179.856 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.03 20.15 2.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 3.3399999999999999 110.853 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . 0.497 HG12 ' HG2' ' A' ' 786' ' ' GLU . 1.7 p -136.18 -26.33 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.777 -0.647 . . . . 1.0900000000000001 110.72 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 24.5 m0 -51.92 126.63 18.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.935 -0.575 . . . . 0.34000000000000002 111.848 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . 0.403 HD21 ' H ' ' A' ' 793' ' ' ASP . 0.0 OUTLIER -93.11 168.67 10.96 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.051 -0.722 . . . . 1.8899999999999999 109.051 178.313 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.409 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 69.8 t80 -54.4 -24.75 21.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.011 0.434 . . . . 0.73999999999999999 110.06 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.619 ' O ' ' HG3' ' A' ' 796' ' ' MET . 26.3 t0 -73.19 -61.78 1.7 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.803 -0.635 . . . . 2.0499999999999998 109.851 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . 0.403 ' H ' HD21 ' A' ' 790' ' ' ASN . 3.0 m-20 -54.01 -27.35 31.31 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.159 -0.473 . . . . 1.0700000000000001 110.045 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 32.1 tp -68.55 -58.12 4.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.783 -0.644 . . . . 1.55 110.403 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.685 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 19.9 mm -56.86 -32.24 38.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.521 -0.763 . . . . 1.0800000000000001 111.647 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.619 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.5 mtt -66.81 -52.87 38.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.7 0.286 . . . . 2.21 110.601 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.89 -54.94 31.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.022 0.439 . . . . 1.0900000000000001 110.192 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.677 HD11 HD13 ' A' ' 851' ' ' ILE . 46.6 mt -56.26 -48.77 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.763 -0.653 . . . . 1.1799999999999999 110.52 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.685 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.2 t-20 -57.96 -23.84 55.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.871 -0.604 . . . . 1.2 111.099 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.81 -24.21 38.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.031 0.444 . . . . 1.52 110.316 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . 0.529 ' HZ3' HD13 ' A' ' 783' ' ' LEU . 0.0 OUTLIER -101.85 -2.34 30.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.766 -0.652 . . . . 2.73 111.297 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.559 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.8 pp -121.2 -25.11 2.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.79 0.328 . . . . 1.4099999999999999 111.414 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 44.1 t . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.285 -0.416 . . . . 2.0099999999999998 110.825 -179.905 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . 0.408 ' HB3' HD22 ' A' ' 799' ' ' ASN . 31.6 Cg_exo . . . . . 0 N--CA 1.47 0.14 0 CA-C-O 120.819 0.258 . . . . 1.3799999999999999 112.269 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.405 HG12 HD11 ' A' ' 802' ' ' ILE . 42.2 pt -136.22 154.68 33.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.9 0.381 . . . . 2.4399999999999999 111.436 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 9.8 p -133.44 -64.23 0.73 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.969 -0.559 . . . . 1.73 110.824 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.44 123.38 32.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.486 . . . . 3.1299999999999999 110.31 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . 0.4 HG23 HD12 ' A' ' 813' ' ' ILE . 1.7 pp -144.65 174.14 3.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.066 0.46 . . . . 1.52 111.89 -179.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -105.54 172.94 6.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.649 -0.705 . . . . 1.4299999999999999 110.32 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.498 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 9.0 p90 -158.03 163.01 38.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.932 0.396 . . . . 1.24 111.421 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . 0.412 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 0.4 OUTLIER -82.32 107.59 15.11 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.902 -0.59 . . . . 2.0899999999999999 110.713 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.854 ' HB3' HG23 ' A' ' 826' ' ' VAL . 0.2 OUTLIER -79.02 -178.76 6.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.479 -0.782 . . . . 1.8 110.795 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . 0.433 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 7.5 pt-20 -82.86 38.61 0.59 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.294 -0.412 . . . . 1.6200000000000001 111.284 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -140.16 9.1 2.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.34 -0.391 . . . . 1.6499999999999999 110.848 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . 0.409 ' HA2' ' NE2' ' A' ' 819' ' ' GLN . . . 65.1 49.08 63.96 Favored Glycine 0 C--N 1.331 0.258 0 C-N-CA 120.682 -0.771 . . . . 0.88 112.287 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -169.29 134.3 1.5 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.982 0.42 . . . . 1.8600000000000001 110.617 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.498 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 94.5 m-85 -63.69 136.03 57.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.881 -0.599 . . . . 0.80000000000000004 110.871 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.854 HG23 ' HB3' ' A' ' 820' ' ' ASP . 3.0 m -126.46 179.15 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 1.73 110.595 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.93 114.53 36.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.954 0.407 . . . . 1.21 111.537 -179.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 4.8 tp -83.17 122.44 28.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.809 -0.632 . . . . 1.52 110.86 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.29 -75.36 0.48 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.783 -0.722 . . . . 1.0900000000000001 112.619 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -161.75 -141.97 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 110.499 -0.186 . . . . 1.8 110.499 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -59.41 -16.39 22.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.729 0.3 . . . . 2.2000000000000002 110.84 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -75.05 -66.32 0.77 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.235 -0.439 . . . . 2.21 110.613 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.494 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 13.4 m-20 -61.59 -15.15 36.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.285 -0.416 . . . . 0.72999999999999998 110.263 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.417 ' O ' ' HG3' ' A' ' 838' ' ' LYS . 2.8 t-105 -82.37 -39.27 22.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.29999999999999999 109.59 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . 0.673 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -69.61 -37.74 76.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.86 -0.609 . . . . 2.8500000000000001 109.751 178.776 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . 0.439 HG23 ' ND2' ' A' ' 835' ' ' ASN . 24.3 t -69.88 -54.65 18.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.557 -0.747 . . . . 1.4399999999999999 109.675 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -55.97 -24.72 40.14 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.855 -0.612 . . . . 1.04 110.324 179.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.673 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 27.8 mtmt -71.88 -45.49 61.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.835 -0.62 . . . . 1.3600000000000001 110.317 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -65.22 -17.64 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.835 -0.621 . . . . 1.95 110.349 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 840' ' ' MET . . . . . 0.433 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 6.2 ttp -83.46 -33.85 25.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.683 -0.69 . . . . 1.0900000000000001 110.403 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.61 HD22 ' HB3' ' A' ' 846' ' ' GLU . 20.5 mt -68.84 -45.79 70.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 1.1799999999999999 110.898 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.478 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -64.88 -28.14 69.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 1.1799999999999999 111.407 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.81 8.26 0.93 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.227 -0.442 . . . . 1.6799999999999999 110.74 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.478 ' H ' ' C ' ' A' ' 842' ' ' ALA . 11.2 m-80 -146.53 16.56 1.29 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.018 -0.537 . . . . 1.96 110.802 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 59.93 19.6 8.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.051 -0.522 . . . . 2.4700000000000002 111.128 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.61 ' HB3' HD22 ' A' ' 841' ' ' LEU . 3.2 mt-10 -83.5 170.85 13.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.422 -0.354 . . . . 2.2999999999999998 110.654 179.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.07 -30.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.425 -0.352 . . . . 2.46 111.273 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.444 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 4.1 m-85 -82.4 143.09 31.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.918 0.39 . . . . 1.52 111.041 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.552 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.5 OUTLIER -122.29 121.33 36.5 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.04 -0.527 . . . . 1.3799999999999999 110.744 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.44 ' OD1' HG22 ' A' ' 782' ' ' THR . 4.6 m-20 -75.45 161.65 29.03 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.993 -0.549 . . . . 1.5600000000000001 111.327 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.677 HD13 HD11 ' A' ' 798' ' ' ILE . 6.0 mt . . . . . 0 C--N 1.334 -0.104 0 CA-C-N 116.184 -0.462 . . . . 1.73 111.025 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.455 HG21 ' OD1' ' A' ' 850' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.711 0.291 . . . . 1.75 110.855 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.586 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.37 97.45 1.23 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.985 0.422 . . . . 1.3600000000000001 109.911 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -96.86 94.14 7.07 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.297 0.57 . . . . 1.1899999999999999 110.765 -179.438 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . 0.422 ' O ' HG12 ' A' ' 785' ' ' VAL . 0.2 OUTLIER -92.16 114.65 27.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.42 -0.809 . . . . 2.1499999999999999 111.036 -179.489 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.8 tt -62.12 103.99 0.43 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.072 -0.513 . . . . 1.53 110.535 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.422 HG12 ' O ' ' A' ' 783' ' ' LEU . 26.3 m -98.4 -172.0 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.979 -0.555 . . . . 1.79 111.413 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.43 176.27 8.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.138 -0.483 . . . . 1.3999999999999999 110.882 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.98 35.46 0.79 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.097 0.475 . . . . 3.3399999999999999 110.806 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.0 p -150.77 -28.38 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.674 -0.694 . . . . 1.0900000000000001 110.896 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 23.3 m0 -49.06 124.24 8.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.826 -0.624 . . . . 0.34000000000000002 111.736 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.66 166.66 12.68 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.142 -0.688 . . . . 1.8899999999999999 109.142 178.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.434 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 77.2 t80 -52.83 -24.1 8.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.944 0.402 . . . . 0.73999999999999999 110.172 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.624 ' O ' ' HG3' ' A' ' 796' ' ' MET . 2.1 t70 -72.25 -62.49 1.42 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.868 -0.605 . . . . 2.0499999999999998 109.697 178.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . 0.684 ' HA ' ' HE3' ' A' ' 796' ' ' MET . 1.6 t0 -53.63 -27.02 24.71 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 116.158 -0.474 . . . . 1.0700000000000001 110.356 179.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.455 ' HA ' HD13 ' A' ' 794' ' ' LEU . 26.9 tp -70.19 -54.34 13.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.858 -0.61 . . . . 1.55 110.478 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.669 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 23.5 mm -59.23 -34.1 52.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.654 -0.703 . . . . 1.0800000000000001 111.868 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.684 ' HE3' ' HA ' ' A' ' 793' ' ' ASP . 21.8 mtm -71.17 -43.4 67.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.636 0.255 . . . . 2.21 111.067 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.95 79.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.272 0.558 . . . . 1.0900000000000001 109.975 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.401 ' O ' HG23 ' A' ' 802' ' ' ILE . 48.1 mt -62.94 -47.8 91.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.446 -0.797 . . . . 1.1799999999999999 110.281 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.717 ' HA ' HG12 ' A' ' 802' ' ' ILE . 0.8 OUTLIER -56.13 -29.58 60.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.846 -0.616 . . . . 1.2 111.133 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.84 -29.49 58.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 1.52 110.848 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . 0.51 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -94.41 -3.93 49.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 2.73 111.467 -179.77 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.717 HG12 ' HA ' ' A' ' 799' ' ' ASN . 7.0 pt -113.76 -22.15 5.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.761 0.315 . . . . 1.4099999999999999 111.244 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.258 -0.428 . . . . 2.0099999999999998 111.006 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.833 0.264 . . . . 1.3799999999999999 112.484 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 4.4 mm -107.61 148.7 11.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 2.4399999999999999 111.092 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 82.1 p -115.94 -47.2 2.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.25 -0.432 . . . . 1.73 111.374 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.94 139.18 30.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.266 -0.425 . . . . 3.1299999999999999 111.093 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -150.63 168.77 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.126 -0.488 . . . . 1.52 111.169 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 14.6 mmtt -115.45 134.63 54.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 1.4299999999999999 110.646 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.452 ' HB2' HD13 ' A' ' 849' ' ' LEU . 5.4 p90 -113.33 168.48 9.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.893 0.378 . . . . 1.24 111.26 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -93.68 105.99 17.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.975 -0.557 . . . . 2.0899999999999999 110.761 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.819 ' HB2' HG22 ' A' ' 826' ' ' VAL . 4.6 t0 -79.07 169.65 17.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.83 -0.623 . . . . 1.8 110.373 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.9 52.65 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.189 0.518 . . . . 1.6200000000000001 111.105 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 -141.05 1.5 1.65 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.679 -0.691 . . . . 1.6499999999999999 110.463 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 74.6 44.44 26.39 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.882 -0.675 . . . . 0.88 111.982 -179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -174.08 142.44 0.84 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 121.164 0.507 . . . . 1.8600000000000001 110.57 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.426 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 70.6 m-85 -72.25 147.26 46.64 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.625 -0.716 . . . . 0.80000000000000004 110.462 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.819 HG22 ' HB2' ' A' ' 820' ' ' ASP . 2.4 m -137.48 177.92 5.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.305 -0.407 . . . . 1.73 110.726 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.93 118.65 45.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.019 0.438 . . . . 1.21 111.35 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.54 HD13 ' HB3' ' A' ' 833' ' ' ASP . 3.5 tp -79.75 113.67 18.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.767 -0.651 . . . . 1.52 110.745 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -58.01 -71.75 0.7 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.995 -0.621 . . . . 1.0900000000000001 112.751 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 57.4 p -171.07 -136.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.502 0.191 . . . . 1.8 110.732 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.456 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 0.7 OUTLIER -57.85 -20.59 37.44 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.771 0.32 . . . . 2.2000000000000002 110.967 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . 0.475 ' O ' HG21 ' A' ' 836' ' ' VAL . 0.5 OUTLIER -72.62 -68.29 0.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.428 . . . . 2.21 110.947 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.54 ' HB3' HD13 ' A' ' 828' ' ' LEU . 0.6 OUTLIER -60.9 -13.35 15.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.72999999999999998 110.793 179.776 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.474 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.5 t-105 -86.26 -40.38 15.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.9 0.381 . . . . 0.29999999999999999 110.111 179.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . 0.711 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -68.91 -37.09 78.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.95 -0.568 . . . . 2.8500000000000001 109.885 179.064 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . 0.475 HG21 ' O ' ' A' ' 832' ' ' GLU . 39.9 t -72.25 -54.47 16.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.462 -0.79 . . . . 1.4399999999999999 110.149 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -58.01 -25.48 61.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.0 -0.545 . . . . 1.04 110.601 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.711 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 23.8 mtmt -69.73 -42.67 73.66 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.169 -0.469 . . . . 1.3600000000000001 110.191 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . 0.408 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 5.0 mt-10 -68.11 -25.93 65.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.061 -0.518 . . . . 1.95 110.161 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 12.4 ttp -74.97 -35.72 62.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.746 -0.661 . . . . 1.0900000000000001 110.497 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.714 HD21 ' HB3' ' A' ' 846' ' ' GLU . 15.4 mt -67.69 -49.21 63.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.088 -0.506 . . . . 1.1799999999999999 110.917 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.431 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -80.46 -0.34 36.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 1.1799999999999999 111.544 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 0.5 OUTLIER -66.43 -0.86 2.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.998 0.428 . . . . 1.6799999999999999 110.377 179.466 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 842' ' ' ALA . 41.8 m-80 -149.74 -71.2 0.19 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.847 -0.615 . . . . 1.96 110.63 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -177.82 26.33 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.959 -0.564 . . . . 2.4700000000000002 111.162 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.714 ' HB3' HD21 ' A' ' 841' ' ' LEU . 2.6 mt-10 -100.62 140.93 34.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.824 0.345 . . . . 2.2999999999999998 110.876 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.3 2.84 2.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 2.46 110.931 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -111.02 126.03 54.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.358 -0.383 . . . . 1.52 110.947 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.503 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.0 OUTLIER -97.37 133.32 42.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.083 -0.508 . . . . 1.3799999999999999 110.697 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.46 ' OD1' HG23 ' A' ' 782' ' ' THR . 6.5 m-20 -85.59 153.93 22.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 1.5600000000000001 111.197 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.586 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.4 mm . . . . . 0 C--N 1.332 -0.161 0 CA-C-N 116.202 -0.454 . . . . 1.73 111.096 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.074 0 CA-C-O 120.676 0.274 . . . . 1.75 110.719 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.584 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -133.59 78.44 1.77 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.112 0.482 . . . . 1.3600000000000001 110.113 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.1 OUTLIER -98.46 115.7 29.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 1.1899999999999999 111.378 -179.401 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . 0.499 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -116.9 -167.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.709 -0.678 . . . . 2.1499999999999999 110.672 179.832 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -116.34 110.92 19.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.028 -0.533 . . . . 1.53 110.372 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.433 HG21 ' HH2' ' A' ' 834' ' ' TRP . 28.8 m -107.45 158.57 7.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 1.79 111.539 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.65 ' HG2' HG12 ' A' ' 788' ' ' VAL . 1.1 tt0 -110.18 171.06 7.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.983 -0.553 . . . . 1.3999999999999999 110.725 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -79.19 -9.36 59.54 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.039 0.447 . . . . 3.3399999999999999 110.783 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . 0.65 HG12 ' HG2' ' A' ' 786' ' ' GLU . 2.7 p -96.06 -24.26 4.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.785 -0.643 . . . . 1.0900000000000001 110.848 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -56.73 126.17 25.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.34000000000000002 111.931 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.85 167.94 10.79 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.009 -0.737 . . . . 1.8899999999999999 109.009 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.419 ' O ' HG12 ' A' ' 795' ' ' ILE . 80.6 t80 -54.67 -24.3 21.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.885 0.374 . . . . 0.73999999999999999 110.069 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.525 ' O ' ' HG3' ' A' ' 796' ' ' MET . 24.1 m-20 -73.58 -57.6 3.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.979 -0.555 . . . . 2.0499999999999998 109.758 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.31 -30.5 64.8 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.166 -0.47 . . . . 1.0700000000000001 110.124 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 30.2 tp -65.46 -54.72 24.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.712 -0.676 . . . . 1.55 110.281 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.644 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 30.3 mm -57.25 -27.98 29.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.484 -0.78 . . . . 1.0800000000000001 111.535 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.525 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.5 mtt -68.18 -51.01 50.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.716 0.294 . . . . 2.21 110.548 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.04 -53.06 58.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.057 0.456 . . . . 1.0900000000000001 109.911 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.782 HD12 HD13 ' A' ' 851' ' ' ILE . 74.2 mt -57.49 -53.02 49.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.643 -0.708 . . . . 1.1799999999999999 110.428 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.644 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.7 OUTLIER -54.96 -24.64 24.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.563 -0.744 . . . . 1.2 111.283 -179.852 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 42.1 t -78.79 -27.56 44.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.349 -0.387 . . . . 1.52 110.537 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.41 4.6 36.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.985 -0.552 . . . . 2.73 111.358 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.72 HD11 HG12 ' A' ' 813' ' ' ILE . 1.0 OUTLIER -127.22 -23.63 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 111.933 0.346 . . . . 1.4099999999999999 111.933 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.415 ' N ' HG13 ' A' ' 802' ' ' ILE . 34.9 t . . . . . 0 C--N 1.33 -0.24 0 CA-C-O 120.729 0.299 . . . . 2.0099999999999998 111.078 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo . . . . . 0 C--O 1.231 0.148 0 CA-C-O 120.728 0.22 . . . . 1.3799999999999999 112.105 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.72 HG12 HD11 ' A' ' 802' ' ' ILE . 8.7 pt -140.93 -176.25 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.959 0.409 . . . . 2.4399999999999999 111.294 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 814' ' ' THR . . . . . 0.508 ' HA ' HD11 ' A' ' 795' ' ' ILE . 1.6 t -158.57 -40.42 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.97 -0.559 . . . . 1.73 110.981 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.79 126.92 52.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.081 -0.509 . . . . 3.1299999999999999 110.821 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -155.27 -176.17 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 1.52 111.365 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -108.64 169.67 8.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 1.4299999999999999 110.595 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.421 ' CE1' HG21 ' A' ' 826' ' ' VAL . 11.0 p90 -157.29 157.25 33.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.988 0.423 . . . . 1.24 111.191 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . 0.502 ' HA ' ' O ' ' A' ' 824' ' ' ASP . 55.3 tt0 -76.33 102.15 5.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.897 -0.592 . . . . 2.0899999999999999 111.039 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -79.24 -176.01 4.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.587 -0.733 . . . . 1.8 110.627 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -81.79 15.13 2.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.362 -0.381 . . . . 1.6200000000000001 111.185 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.34 6.11 44.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.432 . . . . 1.6499999999999999 111.07 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 75.2 16.35 80.65 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.736 . . . . 0.88 112.482 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . 0.502 ' O ' ' HA ' ' A' ' 819' ' ' GLN . 2.8 t0 -143.49 -147.35 0.21 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.754 0.311 . . . . 1.8600000000000001 110.358 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.403 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 49.3 m-85 -129.02 150.89 50.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.295 -0.411 . . . . 0.80000000000000004 110.895 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.421 HG21 ' CE1' ' A' ' 818' ' ' TYR . 8.4 m -139.14 -178.58 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 1.73 110.558 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -98.64 113.41 33.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.969 0.414 . . . . 1.21 111.682 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -80.36 120.27 24.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.909 -0.587 . . . . 1.52 110.63 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -68.48 -72.5 0.81 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.847 -0.692 . . . . 1.0900000000000001 112.621 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.79 -136.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.492 0.187 . . . . 1.8 110.51 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -59.61 -16.26 24.52 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.702 0.287 . . . . 2.2000000000000002 110.822 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . 0.462 ' O ' HG23 ' A' ' 836' ' ' VAL . 32.0 mt-10 -74.89 -70.4 0.41 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.284 -0.417 . . . . 2.21 110.827 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.581 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 21.8 m-20 -61.77 -11.76 13.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.72999999999999998 110.841 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.477 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 2.0 t-105 -84.01 -40.7 18.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.891 0.377 . . . . 0.29999999999999999 110.17 179.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . 0.737 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -69.07 -35.22 76.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 2.8500000000000001 110.024 179.112 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 832' ' ' GLU . 13.2 t -74.71 -53.56 16.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 1.4399999999999999 110.132 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.581 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -56.57 -27.16 57.22 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.124 -0.489 . . . . 1.04 110.488 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.737 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 21.4 mtmt -68.55 -47.89 65.71 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.988 -0.551 . . . . 1.3600000000000001 110.336 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.97 -25.63 67.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.485 . . . . 1.95 110.27 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.7 ttp -73.05 -35.21 66.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.779 -0.646 . . . . 1.0900000000000001 110.269 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.646 HD23 ' HB3' ' A' ' 846' ' ' GLU . 6.0 mt -67.67 -50.76 56.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.825 -0.625 . . . . 1.1799999999999999 110.659 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.435 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.18 -2.28 36.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.11 -0.495 . . . . 1.1799999999999999 111.263 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.85 -4.92 2.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.001 0.429 . . . . 1.6799999999999999 110.211 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.435 ' H ' ' C ' ' A' ' 842' ' ' ALA . 3.1 m120 -147.67 -71.22 0.22 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.633 -0.712 . . . . 1.96 110.538 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 177.36 30.18 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.906 -0.588 . . . . 2.4700000000000002 110.725 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.646 ' HB3' HD23 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -96.0 142.16 28.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 2.2999999999999998 111.292 -179.602 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -136.49 -4.77 2.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.014 -0.539 . . . . 2.46 110.658 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.499 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 58.3 m-85 -91.33 136.26 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.957 -0.565 . . . . 1.52 110.905 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.503 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.3 OUTLIER -128.91 124.0 34.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 1.3799999999999999 111.122 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.4 ' C ' HG12 ' A' ' 851' ' ' ILE . 3.4 m-20 -85.46 169.14 13.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.075 -0.511 . . . . 1.5600000000000001 110.851 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.782 HD13 HD12 ' A' ' 798' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.434 -0.348 . . . . 1.73 111.51 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.789 0.328 . . . . 1.75 111.038 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.717 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.46 95.44 1.12 Allowed 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.999 0.428 . . . . 1.3600000000000001 110.077 179.744 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -97.54 89.33 4.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.997 -0.547 . . . . 1.1899999999999999 111.0 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.27 137.51 32.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 2.1499999999999999 110.682 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.61 107.49 0.96 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.114 0.483 . . . . 1.53 110.45 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.418 ' HB ' ' O ' ' A' ' 847' ' ' LYS . 17.6 t -96.29 136.04 28.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.497 -0.774 . . . . 1.79 110.712 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -97.3 165.32 12.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 1.3999999999999999 110.969 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.01 51.1 2.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.069 -0.514 . . . . 3.3399999999999999 110.651 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 1.5 p -164.53 -28.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.882 -0.599 . . . . 1.0900000000000001 110.605 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 26.4 m0 -47.75 130.83 14.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.608 -0.724 . . . . 0.34000000000000002 112.035 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.82 168.28 10.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.831 -0.803 . . . . 1.8899999999999999 108.831 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -53.34 -24.14 11.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.005 0.431 . . . . 0.73999999999999999 110.329 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.64 ' O ' ' HG3' ' A' ' 796' ' ' MET . 17.5 m-20 -76.85 -60.61 2.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.846 -0.615 . . . . 2.0499999999999998 109.66 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -55.14 -21.83 14.64 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-O 121.093 0.473 . . . . 1.0700000000000001 109.804 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.46 ' HA ' HD12 ' A' ' 794' ' ' LEU . 40.2 tp -73.81 -60.24 2.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.535 -0.757 . . . . 1.55 110.365 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.659 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 19.0 mm -57.1 -36.65 52.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.394 -0.821 . . . . 1.0800000000000001 111.988 -179.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.64 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.2 mtt -69.59 -39.44 77.3 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.68 0.276 . . . . 2.21 110.837 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -65.34 -50.77 64.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.211 0.529 . . . . 1.0900000000000001 110.05 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.447 HD13 HD11 ' A' ' 794' ' ' LEU . 31.0 mt -61.4 -48.26 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 115.495 -0.775 . . . . 1.1799999999999999 110.349 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.659 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.9 OUTLIER -56.35 -34.79 66.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.765 -0.652 . . . . 1.2 110.952 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.96 -24.07 60.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.266 -0.425 . . . . 1.52 110.715 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . 0.575 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -99.29 -2.21 37.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.075 -0.511 . . . . 2.73 111.419 -179.887 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.658 HD11 HG12 ' A' ' 813' ' ' ILE . 1.3 pp -116.13 -22.91 4.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.718 0.294 . . . . 1.4099999999999999 111.533 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 55.7 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.344 -0.389 . . . . 2.0099999999999998 110.9 -179.804 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo . . . . . 0 C--O 1.232 0.191 0 CA-C-O 120.771 0.238 . . . . 1.3799999999999999 112.395 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.658 HG12 HD11 ' A' ' 802' ' ' ILE . 5.5 pt -146.55 171.32 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.276 -0.42 . . . . 2.4399999999999999 111.07 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 19.4 p -128.82 -67.3 0.79 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.193 -0.458 . . . . 1.73 111.129 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.3 mptt -83.51 137.84 33.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 3.1299999999999999 110.736 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -152.03 -178.18 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.296 -0.411 . . . . 1.52 111.603 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . 0.494 ' HE2' HG12 ' A' ' 827' ' ' VAL . 6.8 mmtt -120.24 155.02 34.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.86 -0.609 . . . . 1.4299999999999999 110.691 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.534 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 5.2 p90 -136.47 174.29 10.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.468 -0.333 . . . . 1.24 111.133 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -96.09 106.58 18.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.213 -0.449 . . . . 2.0899999999999999 111.043 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.85 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.7 t70 -79.31 173.3 12.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.8 -0.637 . . . . 1.8 110.938 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . 0.408 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 3.0 pt-20 -79.21 33.55 0.23 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.224 -0.444 . . . . 1.6200000000000001 111.19 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . 0.414 ' H ' ' C ' ' A' ' 820' ' ' ASP . 3.7 m-20 -128.85 8.88 5.77 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.225 -0.443 . . . . 1.6499999999999999 110.554 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 64.22 51.89 48.93 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.86 -0.686 . . . . 0.88 112.414 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -176.03 141.13 0.44 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.146 0.498 . . . . 1.8600000000000001 110.598 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.534 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 58.9 m-85 -66.73 145.25 55.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.636 -0.711 . . . . 0.80000000000000004 110.747 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.85 HG22 ' HB2' ' A' ' 820' ' ' ASP . 0.9 OUTLIER -138.51 178.1 4.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 1.73 110.824 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . 0.494 HG12 ' HE2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -99.1 116.46 42.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.0 0.428 . . . . 1.21 111.326 -179.736 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 4.3 tp -82.33 108.17 15.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.8 -0.636 . . . . 1.52 110.876 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -58.09 -69.38 1.3 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.863 -0.684 . . . . 1.0900000000000001 112.691 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 830' ' ' SER . . . . . 0.426 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 3.0 p -170.07 -143.42 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 110.497 -0.186 . . . . 1.8 110.497 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.426 ' H ' ' HB2' ' A' ' 830' ' ' SER . 20.2 t70 -56.48 -19.17 14.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.716 0.293 . . . . 2.2000000000000002 110.831 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -70.47 -68.49 0.42 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.356 -0.384 . . . . 2.21 110.552 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.33 -12.22 28.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.399 -0.364 . . . . 0.72999999999999998 110.357 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.538 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.0 OUTLIER -82.68 -44.41 15.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.061 -0.518 . . . . 0.29999999999999999 110.363 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -35.25 80.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.049 -0.523 . . . . 2.8500000000000001 109.947 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.11 -54.6 14.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.546 -0.752 . . . . 1.4399999999999999 110.079 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.82 -26.52 46.84 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.095 -0.502 . . . . 1.04 110.506 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -67.42 -50.13 60.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.075 -0.511 . . . . 1.3600000000000001 110.277 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -58.64 -24.5 61.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.938 -0.574 . . . . 1.95 110.136 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 840' ' ' MET . . . . . 0.408 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 6.7 ttp -74.86 -36.4 62.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.691 -0.686 . . . . 1.0900000000000001 110.444 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.632 HD22 ' HB3' ' A' ' 846' ' ' GLU . 17.0 mt -60.7 -43.23 98.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.082 -0.508 . . . . 1.1799999999999999 110.433 179.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.482 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -74.3 -27.39 60.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.545 . . . . 1.1799999999999999 111.181 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.35 7.63 0.99 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.048 -0.524 . . . . 1.6799999999999999 110.708 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.482 ' H ' ' C ' ' A' ' 842' ' ' ALA . 24.1 m-80 -148.04 17.2 1.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.062 -0.517 . . . . 1.96 110.714 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.7 t30 60.22 12.59 3.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.17 -0.468 . . . . 2.4700000000000002 110.872 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.632 ' HB3' HD22 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -77.16 171.01 15.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.973 -0.558 . . . . 2.2999999999999998 111.142 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . 0.418 ' O ' ' HB ' ' A' ' 785' ' ' VAL . 0.0 OUTLIER -152.21 -37.12 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.628 -0.714 . . . . 2.46 110.244 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -83.49 147.14 27.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.019 -0.537 . . . . 1.52 110.783 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.6 OUTLIER -123.38 132.63 54.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.219 -0.446 . . . . 1.3799999999999999 111.026 179.74 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -85.65 154.15 21.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 1.5600000000000001 110.936 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.717 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.331 -0.214 0 CA-C-N 116.21 -0.45 . . . . 1.73 111.047 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.636 0.255 . . . . 1.75 111.097 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.497 ' HB3' ' CD1' ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.79 99.58 2.01 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 109.097 -0.705 . . . . 1.3600000000000001 109.097 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.602 HG21 ' HB3' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -96.46 94.87 7.65 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.723 -0.671 . . . . 1.1899999999999999 110.945 -178.851 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 783' ' ' LEU . 0.2 OUTLIER -100.23 104.84 16.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.521 -0.763 . . . . 2.1499999999999999 110.872 -179.755 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.44 114.08 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.105 -0.498 . . . . 1.53 110.567 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.427 HG13 HD11 ' A' ' 794' ' ' LEU . 30.7 m -103.41 179.55 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.451 -0.795 . . . . 1.79 111.434 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.534 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 5.1 tp10 -122.97 176.7 5.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.968 -0.56 . . . . 1.3999999999999999 110.842 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . 0.534 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 2.5 mttt -90.0 54.96 2.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 3.3399999999999999 110.751 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.4 p -171.44 -27.97 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.107 -0.497 . . . . 1.0900000000000001 111.058 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -50.33 126.13 14.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.816 -0.629 . . . . 0.34000000000000002 112.086 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.89 167.93 11.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.708 -0.849 . . . . 1.8899999999999999 108.708 178.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.446 ' O ' HG12 ' A' ' 795' ' ' ILE . 87.4 t80 -54.51 -27.15 36.11 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.659 -0.416 . . . . 0.73999999999999999 110.179 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.532 ' O ' ' HG3' ' A' ' 796' ' ' MET . 30.4 m-20 -70.71 -56.49 6.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.008 -0.542 . . . . 2.0499999999999998 109.622 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.96 -31.09 66.53 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.138 -0.483 . . . . 1.0700000000000001 110.279 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.427 HD11 HG13 ' A' ' 785' ' ' VAL . 31.7 tp -65.86 -54.48 26.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.826 -0.625 . . . . 1.55 110.468 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.648 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 26.8 mm -54.11 -29.89 19.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.499 -0.773 . . . . 1.0800000000000001 111.744 -179.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.8 mtp -69.03 -51.59 37.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.558 0.218 . . . . 2.21 110.623 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.27 -50.85 66.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.072 0.463 . . . . 1.0900000000000001 110.157 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.531 HD12 HD11 ' A' ' 851' ' ' ILE . 63.6 mt -60.3 -53.37 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.63 -0.714 . . . . 1.1799999999999999 110.556 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.726 HD22 ' HB3' ' A' ' 812' ' ' PRO . 0.2 OUTLIER -54.33 -27.24 34.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.482 -0.781 . . . . 1.2 111.458 -179.749 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.11 -29.18 48.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.438 -0.346 . . . . 1.52 111.099 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . 0.453 ' HE3' ' HA ' ' A' ' 801' ' ' LYS . 0.2 OUTLIER -93.14 -9.29 39.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.397 -0.365 . . . . 2.73 111.488 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.719 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.0 OUTLIER -100.75 -31.0 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.825 0.345 . . . . 1.4099999999999999 111.278 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.529 ' N ' HG13 ' A' ' 802' ' ' ILE . 69.0 p . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.272 -0.422 . . . . 2.0099999999999998 110.817 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . 0.726 ' HB3' HD22 ' A' ' 799' ' ' ASN . 38.9 Cg_exo . . . . . 0 CA--C 1.527 0.133 0 CA-C-O 120.925 0.302 . . . . 1.3799999999999999 112.392 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.658 HG12 HD12 ' A' ' 802' ' ' ILE . 5.5 mm -119.6 161.78 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.038 -0.528 . . . . 2.4399999999999999 110.822 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -131.26 -62.23 0.89 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.54 -0.3 . . . . 1.73 111.414 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.13 142.41 32.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.37 -0.377 . . . . 3.1299999999999999 110.869 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -155.59 167.93 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.066 -0.516 . . . . 1.52 111.267 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . 0.428 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 19.2 mmtt -105.41 149.6 25.99 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.99 -0.55 . . . . 1.4299999999999999 110.572 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.571 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 6.2 p90 -131.13 169.3 16.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.764 0.316 . . . . 1.24 111.356 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -92.14 107.08 18.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.071 -0.513 . . . . 2.0899999999999999 110.884 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.803 ' HB2' HG23 ' A' ' 826' ' ' VAL . 13.4 t70 -79.0 173.91 12.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.737 -0.665 . . . . 1.8 110.964 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . 0.641 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 12.4 pt-20 -71.02 0.92 6.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.244 -0.434 . . . . 1.6200000000000001 111.439 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.61 13.79 32.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.399 -0.364 . . . . 1.6499999999999999 110.796 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 55.58 55.22 29.81 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.812 -0.708 . . . . 0.88 112.277 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -171.93 135.37 0.82 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.006 0.432 . . . . 1.8600000000000001 110.553 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.571 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 65.3 m-85 -63.67 131.43 47.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.879 -0.6 . . . . 0.80000000000000004 110.895 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.803 HG23 ' HB2' ' A' ' 820' ' ' ASP . 1.8 m -127.63 -179.07 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.234 -0.439 . . . . 1.73 110.789 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . 0.422 HG22 ' HZ1' ' A' ' 817' ' ' LYS . 2.5 t -98.75 116.94 42.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.054 0.454 . . . . 1.21 111.295 -179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.71 108.0 12.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 1.52 110.689 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -56.8 -67.13 2.38 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.829 -0.7 . . . . 1.0900000000000001 112.692 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 830' ' ' SER . . . . . 0.426 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -173.86 -137.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.421 -0.214 . . . . 1.8 110.421 -179.791 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.46 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 28.3 t70 -59.88 -16.19 27.26 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.745 0.307 . . . . 2.2000000000000002 110.751 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.41 -69.43 0.4 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 2.21 110.854 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.601 ' O ' ' HB2' ' A' ' 837' ' ' ALA . 1.6 m-20 -62.91 -12.46 25.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.72999999999999998 110.519 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.444 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 3.4 t-105 -84.68 -39.67 18.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.277 -0.42 . . . . 0.29999999999999999 110.189 179.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . 0.695 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.3 OUTLIER -70.28 -33.48 71.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 2.8500000000000001 109.836 179.011 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 66.6 t -74.84 -55.9 10.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.476 -0.784 . . . . 1.4399999999999999 110.203 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.601 ' HB2' ' O ' ' A' ' 833' ' ' ASP . . . -56.12 -27.27 53.32 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.211 -0.449 . . . . 1.04 110.413 179.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.695 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 25.5 mtmt -66.44 -51.38 57.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.005 -0.543 . . . . 1.3600000000000001 110.359 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.69 -28.22 68.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 1.95 110.178 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 840' ' ' MET . . . . . 0.641 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 11.9 ttp -70.74 -36.71 73.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.715 -0.675 . . . . 1.0900000000000001 110.216 179.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 49.4 mt -67.04 -42.76 84.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.865 -0.607 . . . . 1.1799999999999999 110.914 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.47 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -72.01 -24.9 61.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 1.1799999999999999 111.235 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.04 6.11 1.01 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.309 -0.405 . . . . 1.6799999999999999 110.756 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.47 ' H ' ' C ' ' A' ' 842' ' ' ALA . 65.1 m-80 -150.86 21.1 0.79 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.087 -0.506 . . . . 1.96 110.851 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.3 15.1 4.05 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.036 -0.529 . . . . 2.4700000000000002 111.167 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.08 170.58 16.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.919 0.39 . . . . 2.2999999999999998 110.924 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -157.68 -22.28 0.09 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.92 -0.582 . . . . 2.46 111.272 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.602 ' HB3' HG21 ' A' ' 782' ' ' THR . 32.4 m-85 -86.4 122.49 30.43 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.841 0.353 . . . . 1.52 111.174 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.491 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.3 OUTLIER -105.86 121.45 44.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.014 -0.539 . . . . 1.3799999999999999 110.488 179.688 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.427 ' C ' HG13 ' A' ' 851' ' ' ILE . 14.1 m120 -76.82 141.27 40.75 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.457 -0.338 . . . . 1.5600000000000001 111.394 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.531 HD11 HD12 ' A' ' 798' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-N 116.194 -0.457 . . . . 1.73 111.421 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.568 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 1.5 mt . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.749 0.309 . . . . 1.75 111.054 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.738 ' HB3' HD13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -142.61 86.04 1.93 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.704 -0.48 . . . . 1.3600000000000001 109.704 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.561 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 2.1 m -97.76 118.76 35.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.82 -0.627 . . . . 1.1899999999999999 111.33 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . 0.528 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -129.65 -168.3 1.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.731 -0.668 . . . . 2.1499999999999999 111.031 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 784' ' ' LEU . 0.0 OUTLIER -108.05 119.92 40.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.685 -0.688 . . . . 1.53 109.472 178.799 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.505 HG13 ' HZ2' ' A' ' 834' ' ' TRP . 89.1 t -117.69 145.19 23.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.227 -0.442 . . . . 1.79 111.623 -178.648 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.461 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 4.7 tp10 -95.15 168.31 10.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.939 -0.573 . . . . 1.3999999999999999 110.742 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . 0.461 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -85.25 16.52 3.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 3.3399999999999999 110.993 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.09 -26.18 2.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.955 -0.566 . . . . 1.0900000000000001 111.117 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 39.2 m0 -52.85 120.36 5.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.067 -0.515 . . . . 0.34000000000000002 112.103 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . 0.811 HD22 ' HB3' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -94.05 160.4 14.73 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.54 -0.911 . . . . 1.8899999999999999 108.54 178.017 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.425 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 78.3 t80 -44.48 -34.86 2.22 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.542 0.21 . . . . 0.73999999999999999 111.245 -178.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.811 ' HB3' HD22 ' A' ' 790' ' ' ASN . 33.8 t70 -68.62 -51.28 44.01 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.855 -0.424 . . . . 2.0499999999999998 109.855 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . 0.556 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.9 OUTLIER -61.23 -31.73 71.52 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.176 -0.466 . . . . 1.0700000000000001 110.32 179.218 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.427 HD12 ' CZ2' ' A' ' 834' ' ' TRP . 29.8 tp -65.15 -52.98 51.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.648 -0.705 . . . . 1.55 110.198 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.682 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 31.0 mm -54.36 -28.85 19.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.535 -0.757 . . . . 1.0800000000000001 111.212 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 6.1 mtp -67.35 -50.36 60.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.688 0.28 . . . . 2.21 110.443 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -55.06 -54.34 44.29 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.067 0.46 . . . . 1.0900000000000001 110.144 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 65.4 mt -56.73 -51.01 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-N 115.765 -0.652 . . . . 1.1799999999999999 110.394 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.682 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.8 OUTLIER -56.48 -26.66 54.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.536 -0.756 . . . . 1.2 111.319 -179.764 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.75 -24.64 41.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.372 -0.376 . . . . 1.52 111.194 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . 0.415 ' HB3' ' CE2' ' A' ' 781' ' ' PHE . 1.2 mptt -100.02 -6.78 25.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 2.73 111.334 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.599 HD11 ' HB2' ' A' ' 803' ' ' SER . 1.4 pp -109.05 -32.45 2.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.771 0.32 . . . . 1.4099999999999999 111.412 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.599 ' HB2' HD11 ' A' ' 802' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--N 1.332 -0.191 0 CA-C-N 116.383 -0.371 . . . . 2.0099999999999998 111.088 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . 0.512 ' HB2' HD22 ' A' ' 799' ' ' ASN . 42.8 Cg_endo . . . . . 0 C--O 1.232 0.183 0 CA-C-O 120.741 0.225 . . . . 1.3799999999999999 112.215 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.502 HD11 HG22 ' A' ' 816' ' ' ILE . 9.4 pt -140.18 162.68 24.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.344 -0.389 . . . . 2.4399999999999999 111.155 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 5.8 p -129.09 -43.36 1.33 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.182 -0.463 . . . . 1.73 111.156 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.94 114.99 22.08 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.258 -0.428 . . . . 3.1299999999999999 110.925 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . 0.502 HG22 HD11 ' A' ' 813' ' ' ILE . 0.2 OUTLIER -135.75 176.18 8.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.267 -0.424 . . . . 1.52 111.443 -179.847 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . 0.545 ' HE2' HG22 ' A' ' 827' ' ' VAL . 12.3 mmtt -128.16 136.39 51.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.959 -0.564 . . . . 1.4299999999999999 110.403 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.523 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 3.7 p90 -116.35 177.99 4.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.92 0.391 . . . . 1.24 111.421 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . 0.44 HE21 ' HA2' ' A' ' 823' ' ' GLY . 11.2 tp60 -100.1 111.3 23.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.001 -0.545 . . . . 2.0899999999999999 110.741 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.464 ' HB2' HG22 ' A' ' 826' ' ' VAL . 6.5 t70 -79.37 175.17 10.84 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.681 -0.691 . . . . 1.8 110.953 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.37 40.19 0.56 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.252 -0.431 . . . . 1.6200000000000001 111.09 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -140.28 15.7 2.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.342 -0.39 . . . . 1.6499999999999999 110.781 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . 0.44 ' HA2' HE21 ' A' ' 819' ' ' GLN . . . 58.3 54.13 40.15 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.81 -0.71 . . . . 0.88 112.23 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -172.75 133.51 0.58 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.925 0.393 . . . . 1.8600000000000001 110.658 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.523 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 67.0 m-85 -66.37 142.77 57.5 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.013 -0.54 . . . . 0.80000000000000004 110.704 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.487 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.3 OUTLIER -133.42 172.34 16.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 1.73 110.714 179.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . 0.545 HG22 ' HE2' ' A' ' 817' ' ' LYS . 1.8 t -98.78 113.07 32.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 1.21 111.153 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.539 HD23 ' HB2' ' A' ' 834' ' ' TRP . 0.9 OUTLIER -79.68 116.93 20.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.747 -0.661 . . . . 1.52 110.896 -179.745 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -65.72 -64.25 3.55 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.866 -0.683 . . . . 1.0900000000000001 112.615 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 830' ' ' SER . . . . . 0.435 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -171.36 -142.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.533 0.206 . . . . 1.8 110.629 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.566 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 11.1 t70 -57.08 -15.1 4.6 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.724 0.297 . . . . 2.2000000000000002 111.168 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -73.62 0.21 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.438 -0.347 . . . . 2.21 111.021 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.489 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 0.6 OUTLIER -60.74 -12.49 10.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.396 -0.366 . . . . 0.72999999999999998 110.646 179.793 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.539 ' HB2' HD23 ' A' ' 828' ' ' LEU . 3.7 t-105 -85.36 -39.85 17.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.385 -0.371 . . . . 0.29999999999999999 110.145 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . 0.723 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -69.43 -35.42 75.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.133 0.492 . . . . 2.8500000000000001 109.879 178.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 25.2 t -73.46 -55.19 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.625 -0.716 . . . . 1.4399999999999999 110.071 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -55.8 -27.64 52.2 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.058 -0.519 . . . . 1.04 110.374 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.723 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.3 mtmt -66.92 -47.92 70.26 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.972 -0.558 . . . . 1.3600000000000001 110.22 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -62.64 -32.64 73.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.042 -0.526 . . . . 1.95 109.946 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -64.63 -31.32 72.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.732 -0.667 . . . . 1.0900000000000001 110.119 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.762 HD22 ' HB3' ' A' ' 846' ' ' GLU . 1.5 mt -72.02 -42.69 66.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.788 -0.642 . . . . 1.1799999999999999 110.814 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.468 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -69.25 -20.52 63.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.463 . . . . 1.1799999999999999 111.197 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -68.07 3.61 1.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.489 . . . . 1.6799999999999999 110.577 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.468 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.12 20.06 0.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 1.96 110.901 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 58.62 19.08 6.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 2.4700000000000002 111.006 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.762 ' HB3' HD22 ' A' ' 841' ' ' LEU . 2.3 mt-10 -71.59 143.03 49.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 2.2999999999999998 110.816 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -136.09 14.59 3.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 2.46 110.751 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.528 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 19.6 m-85 -119.49 128.62 54.14 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.139 -0.482 . . . . 1.52 111.251 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.561 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.4 OUTLIER -115.46 129.06 56.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.005 -0.543 . . . . 1.3799999999999999 110.724 179.821 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -94.81 142.32 27.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.089 -0.505 . . . . 1.5600000000000001 111.183 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.738 HD13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.333 -0.13 0 CA-C-N 116.52 -0.309 . . . . 1.73 111.235 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.446 HG23 ' CG ' ' A' ' 850' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.705 0.288 . . . . 1.75 111.097 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.534 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -139.83 82.91 1.9 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.043 0.449 . . . . 1.3600000000000001 109.805 179.665 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.618 HG23 ' HB3' ' A' ' 848' ' ' PHE . 0.1 OUTLIER -97.86 121.65 40.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.867 -0.606 . . . . 1.1899999999999999 111.458 -178.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . 0.445 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -112.58 -163.67 0.87 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.651 -0.704 . . . . 2.1499999999999999 110.629 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.97 101.89 7.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.161 -0.472 . . . . 1.53 110.341 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 31.4 m -93.36 165.13 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.985 -0.552 . . . . 1.79 111.341 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.465 ' HG3' ' HE3' ' A' ' 787' ' ' LYS . 0.9 OUTLIER -116.99 175.57 5.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 1.3999999999999999 111.028 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . 0.465 ' HE3' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -89.17 54.89 3.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.181 0.515 . . . . 3.3399999999999999 110.735 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -168.31 -26.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.649 -0.705 . . . . 1.0900000000000001 110.587 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 27.3 m0 -52.08 126.11 17.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.693 -0.685 . . . . 0.34000000000000002 111.923 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . 0.494 HD21 ' H ' ' A' ' 793' ' ' ASP . 0.1 OUTLIER -95.25 165.86 12.18 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.944 -0.761 . . . . 1.8899999999999999 108.944 178.314 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.4 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 92.0 t80 -51.42 -24.9 5.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.901 0.381 . . . . 0.73999999999999999 110.297 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.61 ' O ' ' HG3' ' A' ' 796' ' ' MET . 1.5 m-20 -70.5 -62.89 1.22 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.017 -0.538 . . . . 2.0499999999999998 109.74 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . 0.494 ' H ' HD21 ' A' ' 790' ' ' ASN . 1.0 OUTLIER -53.34 -29.26 33.17 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.112 0.482 . . . . 1.0700000000000001 110.336 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.474 HD13 ' CZ2' ' A' ' 834' ' ' TRP . 26.5 tp -67.96 -53.61 24.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.784 -0.644 . . . . 1.55 110.235 179.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.625 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 21.9 mm -60.09 -30.9 46.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.599 -0.728 . . . . 1.0800000000000001 111.211 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.61 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 21.3 mtp -69.13 -51.79 34.82 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.339 -0.245 . . . . 2.21 110.339 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.32 -52.01 62.88 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.014 0.435 . . . . 1.0900000000000001 110.067 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.439 ' O ' HG23 ' A' ' 802' ' ' ILE . 71.5 mt -58.53 -52.48 59.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.636 -0.711 . . . . 1.1799999999999999 110.423 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.631 ' HA ' HG12 ' A' ' 802' ' ' ILE . 7.0 t-20 -56.64 -21.59 28.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.614 -0.721 . . . . 1.2 111.215 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 22.3 t -79.29 -31.42 43.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 1.52 110.618 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -94.91 -8.63 36.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.96 -0.564 . . . . 2.73 111.245 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.769 HD12 HG12 ' A' ' 813' ' ' ILE . 1.3 pt -111.03 -23.94 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.476 -0.329 . . . . 1.4099999999999999 111.36 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.515 ' N ' HG13 ' A' ' 802' ' ' ILE . 3.8 t . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 2.0099999999999998 110.928 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . 0.613 ' HA ' HD13 ' A' ' 802' ' ' ILE . 79.2 Cg_endo . . . . . 0 N--CA 1.465 -0.154 0 CA-C-O 120.834 0.264 . . . . 1.3799999999999999 112.427 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.769 HG12 HD12 ' A' ' 802' ' ' ILE . 35.0 pt -135.77 174.34 12.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.022 -0.535 . . . . 2.4399999999999999 111.046 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.4 -60.75 0.31 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.238 -0.437 . . . . 1.73 111.057 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 1.5 tttp -92.44 126.81 37.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.293 -0.412 . . . . 3.1299999999999999 110.464 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . 0.602 HG21 HD11 ' A' ' 813' ' ' ILE . 1.2 pp -154.09 179.17 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 1.52 111.564 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -109.42 -178.35 3.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 1.4299999999999999 110.215 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.534 ' HB2' HD12 ' A' ' 849' ' ' LEU . 15.3 p90 -156.38 164.11 38.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.716 0.293 . . . . 1.24 111.048 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . 0.438 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.7 OUTLIER -83.53 103.16 12.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.114 0.483 . . . . 2.0899999999999999 110.605 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -79.6 176.31 9.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.638 -0.71 . . . . 1.8 110.982 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . 0.465 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.2 OUTLIER -82.93 27.53 0.54 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 1.6200000000000001 110.954 179.925 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.39 -0.52 14.47 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.239 -0.437 . . . . 1.6499999999999999 110.775 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 84.12 16.69 66.63 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.767 -0.73 . . . . 0.88 112.436 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -143.72 -145.41 0.17 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.743 0.306 . . . . 1.8600000000000001 110.561 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.463 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 97.4 m-85 -129.95 145.95 51.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.965 0.412 . . . . 0.80000000000000004 111.602 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.546 HG13 ' N ' ' A' ' 827' ' ' VAL . 10.0 t -122.55 163.99 20.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.645 -0.707 . . . . 1.73 109.722 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . 0.546 ' N ' HG13 ' A' ' 826' ' ' VAL . 0.2 OUTLIER -97.65 107.52 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.065 0.459 . . . . 1.21 111.296 -179.453 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 5.6 tt -79.6 136.8 36.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.652 -0.704 . . . . 1.52 110.723 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -90.88 -59.39 1.41 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.654 -0.784 . . . . 1.0900000000000001 112.495 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 830' ' ' SER . . . . . 0.441 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.2 OUTLIER -170.5 -141.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.358 -0.238 . . . . 1.8 110.358 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.441 ' H ' ' HB3' ' A' ' 830' ' ' SER . 6.9 t0 -55.96 -23.52 32.69 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.666 0.27 . . . . 2.2000000000000002 110.896 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -64.88 -73.74 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.294 -0.412 . . . . 2.21 110.806 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.424 ' O ' ' HB1' ' A' ' 837' ' ' ALA . 0.4 OUTLIER -60.2 -12.59 9.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.301 -0.409 . . . . 0.72999999999999998 110.636 179.63 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.483 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.5 t-105 -81.37 -39.65 24.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.983 0.42 . . . . 0.29999999999999999 109.961 179.013 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -73.55 -28.87 62.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.999 -0.546 . . . . 2.8500000000000001 109.68 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 24.4 t -75.48 -53.99 14.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.585 -0.734 . . . . 1.4399999999999999 109.706 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.424 ' HB1' ' O ' ' A' ' 833' ' ' ASP . . . -57.81 -29.63 65.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.661 -0.7 . . . . 1.04 110.457 178.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -67.46 -45.43 75.99 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.051 -0.522 . . . . 1.3600000000000001 110.518 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -61.76 -25.23 67.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.001 -0.545 . . . . 1.95 110.326 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 840' ' ' MET . . . . . 0.465 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 18.1 ttp -75.67 -38.44 58.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.68 -0.691 . . . . 1.0900000000000001 110.418 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 12.1 mt -62.76 -53.2 57.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.044 -0.526 . . . . 1.1799999999999999 110.806 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.46 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -62.53 -22.51 66.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 1.1799999999999999 111.039 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -67.7 3.37 1.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.077 -0.51 . . . . 1.6799999999999999 110.661 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.46 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.98 22.57 0.44 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.465 . . . . 1.96 110.935 -180.0 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.7 m120 58.09 19.67 6.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.1 -0.5 . . . . 2.4700000000000002 111.208 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.447 ' OE2' ' HB2' ' A' ' 844' ' ' ASN . 0.1 OUTLIER -82.0 148.48 28.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.296 -0.411 . . . . 2.2999999999999998 110.635 179.803 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -141.68 11.04 2.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 2.46 110.97 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.618 ' HB3' HG23 ' A' ' 782' ' ' THR . 64.9 m-85 -107.18 126.3 52.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.118 -0.492 . . . . 1.52 110.733 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.534 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.3 OUTLIER -123.68 126.56 46.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.232 -0.44 . . . . 1.3799999999999999 111.09 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.449 ' C ' HG12 ' A' ' 851' ' ' ILE . 21.2 m-20 -88.12 -176.3 5.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.051 -0.522 . . . . 1.5600000000000001 110.732 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.534 HD12 ' HB3' ' A' ' 781' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.24 0 CA-C-O 120.811 0.339 . . . . 1.73 111.599 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.528 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.822 0.344 . . . . 1.75 111.151 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.433 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.13 92.32 1.42 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.128 0.49 . . . . 1.3600000000000001 110.025 179.617 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.4 96.3 8.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.818 -0.628 . . . . 1.1899999999999999 110.729 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.38 132.14 44.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.674 -0.694 . . . . 2.1499999999999999 111.128 -179.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . 0.61 HD13 ' HD2' ' A' ' 847' ' ' LYS . 8.5 tt -65.87 107.01 1.69 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.092 -0.504 . . . . 1.53 110.392 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 28.3 m -102.01 173.92 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.521 . . . . 1.79 111.357 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 0.7 OUTLIER -119.4 170.33 9.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 1.3999999999999999 110.833 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . 0.445 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -83.46 14.86 3.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 3.3399999999999999 111.026 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 1.6 p -127.35 -27.44 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.922 -0.581 . . . . 1.0900000000000001 110.909 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -47.92 125.11 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.922 -0.581 . . . . 0.34000000000000002 112.007 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.74 165.93 12.46 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.134 -0.691 . . . . 1.8899999999999999 109.134 178.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -50.98 -26.42 5.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.023 0.439 . . . . 0.73999999999999999 110.213 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.616 ' O ' ' HG3' ' A' ' 796' ' ' MET . 14.0 t70 -71.89 -61.41 1.8 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.863 -0.608 . . . . 2.0499999999999998 109.577 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -53.79 -24.12 14.27 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.07 -0.514 . . . . 1.0700000000000001 110.128 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.55 ' HG ' HD12 ' A' ' 798' ' ' ILE . 32.5 tp -73.56 -57.34 4.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 1.55 110.497 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.683 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.2 mm -58.0 -33.7 46.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.689 -0.687 . . . . 1.0800000000000001 111.901 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.616 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 3.3 mtp -72.32 -44.42 62.7 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.107 -0.237 . . . . 2.21 111.001 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -61.78 -47.29 85.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.167 0.508 . . . . 1.0900000000000001 109.738 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.55 HD12 ' HG ' ' A' ' 794' ' ' LEU . 17.5 mt -63.39 -49.64 81.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.478 -0.783 . . . . 1.1799999999999999 110.126 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.683 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.6 OUTLIER -57.77 -23.76 53.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.838 -0.619 . . . . 1.2 110.909 179.568 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.19 -27.74 38.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 1.52 110.6 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -97.82 -4.18 37.31 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.052 -0.522 . . . . 2.73 111.394 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.583 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.2 pp -113.8 -31.16 2.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.7 0.286 . . . . 1.4099999999999999 111.422 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.467 ' N ' HG13 ' A' ' 802' ' ' ILE . 1.2 m . . . . . 0 C--N 1.33 -0.242 0 CA-C-O 120.926 0.393 . . . . 2.0099999999999998 111.139 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . 0.521 ' HB2' HD22 ' A' ' 799' ' ' ASN . 53.7 Cg_endo . . . . . 0 C--O 1.232 0.202 0 CA-C-O 120.844 0.269 . . . . 1.3799999999999999 112.53 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.433 HG12 HD13 ' A' ' 802' ' ' ILE . 3.4 pt -145.0 163.57 13.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.162 -0.472 . . . . 2.4399999999999999 111.1 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 1.2 p -133.16 -63.01 0.78 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.313 -0.403 . . . . 1.73 111.275 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -82.14 126.11 31.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 3.1299999999999999 110.96 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -153.53 174.88 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 1.52 111.212 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . 0.418 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 15.0 mttt -115.37 152.99 31.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 1.4299999999999999 110.81 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' A' ' 828' ' ' LEU . 6.9 p90 -129.35 179.26 5.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.379 -0.373 . . . . 1.24 110.898 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . 0.498 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -92.86 115.7 28.36 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.461 0.648 . . . . 2.0899999999999999 110.748 179.906 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.483 ' HB2' HG13 ' A' ' 826' ' ' VAL . 7.8 t70 -93.18 177.45 6.05 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 114.859 -1.064 . . . . 1.8 111.132 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -78.92 13.31 1.78 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.103 -0.499 . . . . 1.6200000000000001 111.113 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.48 4.7 46.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.427 . . . . 1.6499999999999999 110.628 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 75.72 10.48 84.85 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.914 -0.66 . . . . 0.88 112.475 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.64 -149.85 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.752 0.31 . . . . 1.8600000000000001 110.472 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.404 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 48.5 m-85 -128.41 139.75 52.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.384 -0.371 . . . . 0.80000000000000004 110.913 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.483 HG13 ' HB2' ' A' ' 820' ' ' ASP . 8.9 m -123.39 173.15 9.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.419 -0.355 . . . . 1.73 110.745 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -98.75 123.53 51.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.036 0.446 . . . . 1.21 111.492 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.468 HD11 ' HB2' ' A' ' 834' ' ' TRP . 5.3 tp -81.76 109.73 16.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 1.52 110.723 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -64.5 -60.72 6.7 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.811 -0.709 . . . . 1.0900000000000001 112.644 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 830' ' ' SER . . . . . 0.536 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -171.23 -142.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.476 -0.194 . . . . 1.8 110.476 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.536 ' H ' ' HB3' ' A' ' 830' ' ' SER . 6.0 p-10 -61.67 -15.4 39.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.896 0.379 . . . . 2.2000000000000002 110.91 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -73.72 -68.8 0.48 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.229 -0.441 . . . . 2.21 110.784 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.516 ' O ' ' HB1' ' A' ' 837' ' ' ALA . 1.7 m-20 -61.18 -13.52 18.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.308 -0.405 . . . . 0.72999999999999998 110.546 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.527 ' HZ3' ' HG ' ' A' ' 849' ' ' LEU . 2.2 t-105 -81.72 -47.48 12.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.198 -0.455 . . . . 0.29999999999999999 110.037 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.31 -32.92 74.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.982 -0.554 . . . . 2.8500000000000001 109.877 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 58.9 t -74.04 -53.93 16.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.474 -0.785 . . . . 1.4399999999999999 109.97 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.516 ' HB1' ' O ' ' A' ' 833' ' ' ASP . . . -53.39 -28.43 29.36 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.03 -0.532 . . . . 1.04 110.185 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.521 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 2.0 mtpp -67.73 -47.9 68.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.765 -0.652 . . . . 1.3600000000000001 110.366 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -60.17 -28.44 67.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.073 -0.512 . . . . 1.95 110.205 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 19.4 ttp -69.92 -39.44 76.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.825 -0.625 . . . . 1.0900000000000001 110.278 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 26.6 mt -66.59 -48.87 68.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.923 -0.58 . . . . 1.1799999999999999 110.705 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.436 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -63.02 -23.47 67.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 1.1799999999999999 110.957 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.36 -0.81 2.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.039 -0.528 . . . . 1.6799999999999999 110.452 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.436 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -144.41 20.36 1.71 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.8 -0.637 . . . . 1.96 110.637 179.762 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.66 25.06 14.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.976 -0.556 . . . . 2.4700000000000002 111.238 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -85.48 171.85 11.46 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.48 -0.327 . . . . 2.2999999999999998 110.727 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . 0.61 ' HD2' HD13 ' A' ' 784' ' ' LEU . 15.3 pttt -159.85 11.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.31 -0.405 . . . . 2.46 111.414 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.45 ' HE1' HD11 ' A' ' 784' ' ' LEU . 29.4 m-85 -120.83 124.39 44.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.893 0.377 . . . . 1.52 111.068 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.527 ' HG ' ' HZ3' ' A' ' 834' ' ' TRP . 0.7 OUTLIER -101.82 116.24 32.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.06 -0.518 . . . . 1.3799999999999999 110.178 179.55 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.498 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 7.2 m120 -72.16 162.69 29.11 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.058 -0.519 . . . . 1.5600000000000001 111.302 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.528 ' O ' ' HA ' ' A' ' 780' ' ' ILE . 3.5 mm . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 116.208 -0.451 . . . . 1.73 111.029 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.422 ' HB ' ' OD1' ' A' ' 850' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.557 0.217 . . . . 1.75 111.029 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.612 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -144.37 87.15 1.86 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.089 0.471 . . . . 1.3600000000000001 110.078 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.441 HG23 ' OD1' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -98.19 91.69 5.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.655 -0.702 . . . . 1.1899999999999999 111.229 -179.336 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.17 144.61 26.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.804 -0.634 . . . . 2.1499999999999999 110.956 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . 0.401 ' HB2' ' HE1' ' A' ' 848' ' ' PHE . 1.2 tt -85.01 114.45 22.18 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.252 -0.431 . . . . 1.53 110.316 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 34.9 m -98.51 -173.69 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.92 -0.582 . . . . 1.79 111.497 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.615 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 3.9 tp10 -133.86 167.92 19.69 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.952 -0.567 . . . . 1.3999999999999999 110.676 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . 0.615 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -82.8 49.52 1.51 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.253 -0.43 . . . . 3.3399999999999999 110.781 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -166.09 -25.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.138 -0.483 . . . . 1.0900000000000001 110.987 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -52.65 123.86 12.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.855 -0.612 . . . . 0.34000000000000002 111.922 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . 0.446 HD21 ' HB2' ' A' ' 792' ' ' ASP . 0.0 OUTLIER -92.23 168.76 11.11 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.804 -0.813 . . . . 1.8899999999999999 108.804 178.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.427 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 63.3 t80 -53.56 -26.11 20.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.139 0.495 . . . . 0.73999999999999999 110.252 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.583 ' O ' ' HG3' ' A' ' 796' ' ' MET . 2.5 m-20 -70.18 -63.72 1.03 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.694 -0.685 . . . . 2.0499999999999998 109.766 178.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.97 -29.8 31.11 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.223 -0.444 . . . . 1.0700000000000001 110.323 179.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.471 HD12 ' CZ2' ' A' ' 834' ' ' TRP . 30.2 tp -66.86 -54.32 23.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.824 -0.626 . . . . 1.55 110.429 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.654 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.9 mm -59.52 -33.06 50.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.639 -0.709 . . . . 1.0800000000000001 111.621 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.583 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 4.7 mtt -68.28 -52.78 29.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.657 0.265 . . . . 2.21 110.499 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.42 -52.89 57.93 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.203 -0.453 . . . . 1.0900000000000001 110.039 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.472 ' O ' HG12 ' A' ' 802' ' ' ILE . 93.4 mt -57.05 -52.39 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.757 -0.656 . . . . 1.1799999999999999 110.583 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.659 ' HA ' HG12 ' A' ' 802' ' ' ILE . 1.1 t-20 -54.68 -29.82 53.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.502 -0.772 . . . . 1.2 111.379 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 29.5 t -75.88 -26.25 56.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.468 -0.333 . . . . 1.52 111.017 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -101.57 -0.43 34.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.273 -0.422 . . . . 2.73 111.566 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.659 HG12 ' HA ' ' A' ' 799' ' ' ASN . 14.0 pt -117.01 -26.38 2.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.681 0.276 . . . . 1.4099999999999999 111.628 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 21.6 p . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 120.979 0.419 . . . . 2.0099999999999998 111.124 -179.966 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . 0.448 ' HB2' HD22 ' A' ' 799' ' ' ASN . 68.9 Cg_endo . . . . . 0 C--O 1.231 0.167 0 CA-C-O 120.847 0.269 . . . . 1.3799999999999999 112.284 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.407 HD12 HG22 ' A' ' 813' ' ' ILE . 2.1 mt -128.52 151.48 35.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.095 -0.502 . . . . 2.4399999999999999 111.364 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.39 -71.44 0.74 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.021 -0.536 . . . . 1.73 110.834 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -83.88 131.62 34.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 3.1299999999999999 110.592 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -151.61 -174.72 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.307 -0.406 . . . . 1.52 111.448 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -116.21 175.38 5.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.567 . . . . 1.4299999999999999 110.173 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.611 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 22.7 p90 -148.44 166.28 28.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.921 0.391 . . . . 1.24 111.112 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . 0.43 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 1.9 tp60 -96.39 108.45 20.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 2.0899999999999999 110.577 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.402 ' HB3' ' CG2' ' A' ' 826' ' ' VAL . 0.1 OUTLIER -79.12 -178.2 6.03 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.756 -0.657 . . . . 1.8 111.064 -179.834 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . 0.523 ' HG2' ' HG3' ' A' ' 840' ' ' MET . 3.2 pt-20 -87.2 33.99 0.68 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.277 -0.42 . . . . 1.6200000000000001 111.59 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -139.17 14.93 2.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.36 -0.382 . . . . 1.6499999999999999 110.735 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 59.84 59.13 11.05 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.842 -0.694 . . . . 0.88 112.237 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -169.36 132.59 1.28 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.965 0.412 . . . . 1.8600000000000001 110.493 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.572 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 49.4 m-85 -73.9 126.51 30.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 0.80000000000000004 111.018 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.611 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 1.3 t -108.27 170.62 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.903 -0.59 . . . . 1.73 111.076 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 1.4 t -99.65 107.0 19.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.33 -0.396 . . . . 1.21 111.197 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.89 110.19 18.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.53 . . . . 1.52 110.736 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -62.42 -65.11 3.36 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.858 -0.686 . . . . 1.0900000000000001 112.605 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 85.1 p -170.2 -131.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.495 -0.187 . . . . 1.8 110.495 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -62.8 -11.57 18.73 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.786 0.327 . . . . 2.2000000000000002 110.906 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -79.07 -68.95 0.61 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.236 -0.438 . . . . 2.21 110.954 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.537 ' O ' ' HB1' ' A' ' 837' ' ' ALA . 0.3 OUTLIER -62.85 -11.99 21.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.297 -0.41 . . . . 0.72999999999999998 110.568 179.714 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.471 ' CZ2' HD12 ' A' ' 794' ' ' LEU . 0.9 OUTLIER -81.31 -45.2 16.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.309 -0.405 . . . . 0.29999999999999999 110.019 179.267 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.69 -36.18 80.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.958 -0.564 . . . . 2.8500000000000001 109.957 178.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 87.9 t -70.2 -53.88 21.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.51 -0.768 . . . . 1.4399999999999999 110.06 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.537 ' HB1' ' O ' ' A' ' 833' ' ' ASP . . . -57.21 -25.06 58.45 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.086 -0.507 . . . . 1.04 109.981 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 1.4 mtpp -65.4 -49.34 69.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.799 -0.637 . . . . 1.3600000000000001 110.096 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.37 -27.07 67.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.866 -0.606 . . . . 1.95 110.449 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 840' ' ' MET . . . . . 0.523 ' HG3' ' HG2' ' A' ' 821' ' ' GLU . 10.8 ttp -74.34 -38.23 63.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.945 -0.57 . . . . 1.0900000000000001 110.515 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.619 HD22 ' HB3' ' A' ' 846' ' ' GLU . 14.3 mt -63.13 -42.24 99.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.085 -0.507 . . . . 1.1799999999999999 110.757 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.486 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -68.16 -23.86 64.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.506 . . . . 1.1799999999999999 111.324 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.41 4.21 1.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 1.6799999999999999 110.639 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.486 ' H ' ' C ' ' A' ' 842' ' ' ALA . 35.5 m-80 -151.88 14.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 1.96 110.867 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.9 m120 62.25 14.9 7.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.148 -0.478 . . . . 2.4700000000000002 111.291 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.619 ' HB3' HD22 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -68.04 169.61 9.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.389 . . . . 2.2999999999999998 110.864 179.725 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.62 -30.67 0.17 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.337 -0.392 . . . . 2.46 111.036 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.401 ' HE1' ' HB2' ' A' ' 784' ' ' LEU . 26.0 m-85 -79.53 149.51 31.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.297 -0.411 . . . . 1.52 110.667 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.477 HD11 ' HB2' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -136.27 114.71 11.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.219 -0.446 . . . . 1.3799999999999999 111.161 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.441 ' OD1' HG23 ' A' ' 782' ' ' THR . 24.8 m-20 -72.36 173.41 8.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.292 -0.413 . . . . 1.5600000000000001 110.718 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.612 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--N 1.332 -0.159 0 CA-C-N 116.414 -0.357 . . . . 1.73 111.492 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.466 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.46 0.063 0 CA-C-O 120.676 0.274 . . . . 1.75 110.792 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.489 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -153.86 89.7 1.33 Allowed 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.919 0.39 . . . . 1.3600000000000001 110.399 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.594 HG21 ' HB3' ' A' ' 848' ' ' PHE . 0.1 OUTLIER -98.36 93.17 6.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.985 -0.552 . . . . 1.1899999999999999 111.111 -179.564 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.76 161.08 14.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.69 -0.686 . . . . 2.1499999999999999 110.886 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . 0.431 HD12 ' HB2' ' A' ' 847' ' ' LYS . 0.3 OUTLIER -96.56 111.79 23.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 1.53 110.269 179.448 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 30.0 m -97.52 -171.41 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.101 -0.499 . . . . 1.79 111.433 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.406 ' O ' ' HD2' ' A' ' 838' ' ' LYS . 0.8 OUTLIER -138.78 170.86 15.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.045 -0.525 . . . . 1.3999999999999999 110.838 -179.771 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . 0.436 ' HE3' ' HB1' ' A' ' 842' ' ' ALA . 15.4 mmtt -85.76 49.98 1.88 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.055 0.455 . . . . 3.3399999999999999 110.512 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.6 p -165.21 -27.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.947 -0.569 . . . . 1.0900000000000001 110.791 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 30.3 m0 -52.6 122.75 9.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.921 -0.582 . . . . 0.34000000000000002 111.85 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . 0.629 HD22 ' HB2' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -95.97 159.22 15.08 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.874 -0.787 . . . . 1.8899999999999999 108.874 178.372 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.481 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 86.4 t80 -44.52 -33.01 1.59 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.698 0.285 . . . . 0.73999999999999999 111.31 -178.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.629 ' HB2' HD22 ' A' ' 790' ' ' ASN . 2.3 m-20 -69.24 -51.91 32.89 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.925 -0.398 . . . . 2.0499999999999998 109.925 178.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . 0.579 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.6 OUTLIER -61.11 -29.53 69.82 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 120.995 0.426 . . . . 1.0700000000000001 110.247 179.205 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 34.2 tp -67.17 -52.32 42.82 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.825 -0.625 . . . . 1.55 110.384 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.655 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 32.8 mm -57.03 -29.09 30.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.549 -0.751 . . . . 1.0800000000000001 111.706 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.549 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 10.1 mtt -67.94 -53.43 26.35 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.668 0.271 . . . . 2.21 110.336 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.0 -54.35 36.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.144 -0.48 . . . . 1.0900000000000001 110.117 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.433 ' O ' HG21 ' A' ' 802' ' ' ILE . 68.5 mt -55.64 -51.1 62.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-N 115.765 -0.652 . . . . 1.1799999999999999 110.356 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.655 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.9 OUTLIER -56.06 -28.45 57.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.624 -0.716 . . . . 1.2 111.338 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 43.0 t -77.24 -23.51 51.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.278 -0.419 . . . . 1.52 110.875 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.07 0.24 27.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 2.73 111.414 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.567 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.7 pt -120.35 -22.21 3.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.571 -0.286 . . . . 1.4099999999999999 111.393 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.425 ' N ' HG13 ' A' ' 802' ' ' ILE . 8.7 t . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.389 -0.369 . . . . 2.0099999999999998 110.999 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo . . . . . 0 C--O 1.232 0.199 0 CA-C-O 120.824 0.26 . . . . 1.3799999999999999 112.257 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.459 HG13 ' CD1' ' A' ' 802' ' ' ILE . 2.3 mt -125.64 149.26 30.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.064 -0.516 . . . . 2.4399999999999999 111.337 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 2.9 p -122.89 -44.42 2.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.996 -0.547 . . . . 1.73 110.836 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.08 130.47 41.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 3.1299999999999999 110.712 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -152.08 168.54 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.972 0.415 . . . . 1.52 111.409 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . 0.447 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 16.7 mmtt -113.66 136.9 52.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.784 -0.644 . . . . 1.4299999999999999 110.385 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.597 ' HB2' HD12 ' A' ' 849' ' ' LEU . 4.2 p90 -114.85 173.32 6.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.811 0.338 . . . . 1.24 111.274 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -100.38 108.29 20.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.081 -0.509 . . . . 2.0899999999999999 110.504 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.842 ' HB2' HG23 ' A' ' 826' ' ' VAL . 4.1 t70 -79.08 173.6 12.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.824 -0.626 . . . . 1.8 110.829 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.11 10.09 2.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.245 -0.434 . . . . 1.6200000000000001 111.043 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.86 10.38 41.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 1.6499999999999999 110.848 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 61.71 51.73 55.46 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.859 -0.686 . . . . 0.88 112.468 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.96 141.87 0.27 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.024 0.44 . . . . 1.8600000000000001 110.429 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.481 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 63.6 m-85 -66.15 142.85 57.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.836 -0.62 . . . . 0.80000000000000004 110.488 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.842 HG23 ' HB2' ' A' ' 820' ' ' ASP . 0.2 OUTLIER -133.1 173.03 15.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.219 -0.446 . . . . 1.73 110.486 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.57 113.71 34.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.931 0.396 . . . . 1.21 111.42 -179.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.9 tt -80.25 115.7 19.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.776 -0.647 . . . . 1.52 110.952 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -61.52 -69.25 1.35 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.852 -0.69 . . . . 1.0900000000000001 112.549 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 830' ' ' SER . . . . . 0.439 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 1.2 p -170.51 -140.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 110.442 -0.207 . . . . 1.8 110.442 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.439 ' H ' ' HB2' ' A' ' 830' ' ' SER . 0.9 OUTLIER -55.61 -24.05 30.98 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.745 0.307 . . . . 2.2000000000000002 111.033 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -64.94 0.8 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.392 -0.367 . . . . 2.21 110.757 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.437 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 3.3 m-20 -61.83 -13.92 28.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.72999999999999998 110.641 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.481 ' HD1' ' N ' ' A' ' 791' ' ' PHE . 5.3 t-105 -86.58 -44.25 12.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.381 -0.372 . . . . 0.29999999999999999 110.192 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -64.84 -27.7 69.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.189 0.518 . . . . 2.8500000000000001 109.835 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 88.4 t -82.54 -58.32 3.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.474 -0.785 . . . . 1.4399999999999999 110.108 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.477 ' O ' ' HE2' ' A' ' 840' ' ' MET . . . -52.94 -30.96 37.64 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.135 -0.484 . . . . 1.04 110.533 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.406 ' HD2' ' O ' ' A' ' 786' ' ' GLU . 11.9 ttpt -69.66 -52.18 28.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.801 -0.636 . . . . 1.3600000000000001 109.979 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.32 -26.55 61.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.438 -0.801 . . . . 1.95 110.162 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 840' ' ' MET . . . . . 0.477 ' HE2' ' O ' ' A' ' 837' ' ' ALA . 12.3 ttp -70.83 -40.87 72.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.772 -0.649 . . . . 1.0900000000000001 110.232 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.459 ' HB3' ' O ' ' A' ' 846' ' ' GLU . 17.4 mt -62.27 -35.22 78.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.736 -0.665 . . . . 1.1799999999999999 110.814 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.476 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -73.82 -22.26 59.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.321 -0.399 . . . . 1.1799999999999999 111.178 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -69.77 6.27 1.22 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 1.6799999999999999 110.667 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.476 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.03 22.36 0.5 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.028 -0.533 . . . . 1.96 110.852 -179.902 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 58.05 16.12 3.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.102 -0.499 . . . . 2.4700000000000002 111.181 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.459 ' O ' ' HB3' ' A' ' 841' ' ' LEU . 3.7 mt-10 -82.72 140.39 33.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 2.2999999999999998 110.807 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . 0.431 ' HB2' HD12 ' A' ' 784' ' ' LEU . 0.1 OUTLIER -135.74 30.6 3.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 2.46 110.759 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.594 ' HB3' HG21 ' A' ' 782' ' ' THR . 8.9 m-85 -125.88 126.0 43.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.117 -0.492 . . . . 1.52 110.889 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.597 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.4 OUTLIER -115.36 117.77 31.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 1.3799999999999999 110.502 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.459 ' C ' HG12 ' A' ' 851' ' ' ILE . 1.9 m-20 -84.21 152.91 23.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.261 -0.427 . . . . 1.5600000000000001 111.481 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.489 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.333 -0.112 0 CA-C-N 116.088 -0.505 . . . . 1.73 111.19 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.582 0.229 . . . . 1.75 110.702 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.697 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.2 OUTLIER -158.23 93.03 1.2 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.982 0.42 . . . . 1.3600000000000001 110.138 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.97 92.21 5.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.024 -0.535 . . . . 1.1899999999999999 110.989 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.08 139.89 30.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.741 -0.663 . . . . 2.1499999999999999 110.962 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.4 tt -72.32 104.21 3.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.935 0.398 . . . . 1.53 110.59 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.641 HG11 ' HZ2' ' A' ' 834' ' ' TRP . 67.8 t -94.68 147.3 5.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.018 -0.537 . . . . 1.79 111.372 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.487 ' N ' HG13 ' A' ' 785' ' ' VAL . 4.2 tt0 -96.06 170.82 9.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 1.3999999999999999 110.548 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.44 54.18 3.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.359 -0.382 . . . . 3.3399999999999999 110.762 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.5 p -166.75 -24.07 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.108 -0.496 . . . . 1.0900000000000001 111.036 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -53.51 122.28 9.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.081 -0.509 . . . . 0.34000000000000002 112.034 -179.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . 0.751 HD22 ' HB2' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -95.33 158.12 15.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.613 -0.884 . . . . 1.8899999999999999 108.613 178.294 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.495 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 92.7 t80 -42.54 -33.81 0.75 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.748 0.308 . . . . 0.73999999999999999 111.336 -178.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.751 ' HB2' HD22 ' A' ' 790' ' ' ASN . 1.5 m-20 -69.02 -55.01 12.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.791 -0.448 . . . . 2.0499999999999998 109.791 178.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . 0.567 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.7 OUTLIER -59.56 -29.71 68.12 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 120.974 0.416 . . . . 1.0700000000000001 110.498 179.302 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 32.4 tp -66.27 -52.95 42.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.897 -0.592 . . . . 1.55 110.217 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.679 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.3 mm -57.26 -31.84 39.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.47 -0.786 . . . . 1.0800000000000001 111.527 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.596 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.2 mtt -68.17 -53.85 22.12 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.983 -0.287 . . . . 2.21 110.539 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -52.27 -53.68 40.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.027 0.442 . . . . 1.0900000000000001 110.085 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.472 ' O ' HG12 ' A' ' 802' ' ' ILE . 94.2 mt -56.81 -53.2 45.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.668 -0.696 . . . . 1.1799999999999999 110.509 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.679 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -53.52 -28.0 28.8 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.648 -0.705 . . . . 1.2 111.285 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.07 -30.91 61.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.466 -0.334 . . . . 1.52 111.065 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.39 0.74 45.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.326 -0.397 . . . . 2.73 111.512 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.579 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 4.1 pt -122.4 -14.65 6.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.67 0.272 . . . . 1.4099999999999999 111.611 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 2.2 t . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.773 0.321 . . . . 2.0099999999999998 111.198 -179.893 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo . . . . . 0 C--O 1.23 0.115 0 CA-C-O 120.773 0.239 . . . . 1.3799999999999999 112.08 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.417 HG21 ' N ' ' A' ' 814' ' ' THR . 14.5 mm -110.56 152.35 12.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.455 . . . . 2.4399999999999999 111.002 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 814' ' ' THR . . . . . 0.417 ' N ' HG21 ' A' ' 813' ' ' ILE . 0.7 OUTLIER -121.58 -56.18 1.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 1.73 111.162 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -92.59 118.47 31.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.247 -0.433 . . . . 3.1299999999999999 110.872 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.61 169.22 21.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.093 -0.503 . . . . 1.52 111.299 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 12.4 mmtt -107.64 172.26 6.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.969 -0.56 . . . . 1.4299999999999999 110.553 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.531 ' HB2' HD12 ' A' ' 849' ' ' LEU . 11.0 p90 -156.19 153.03 28.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.02 0.438 . . . . 1.24 111.524 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -80.04 106.65 12.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.763 -0.653 . . . . 2.0899999999999999 110.694 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.561 ' HB2' HG22 ' A' ' 826' ' ' VAL . 6.9 t0 -78.75 178.51 7.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.552 -0.749 . . . . 1.8 110.819 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -80.11 41.58 0.53 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.227 -0.442 . . . . 1.6200000000000001 111.236 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -139.76 10.87 2.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 1.6499999999999999 110.759 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 62.9 50.15 66.28 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.852 -0.69 . . . . 0.88 112.452 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -173.96 134.95 0.47 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.985 0.421 . . . . 1.8600000000000001 110.659 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -64.17 148.41 50.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.883 -0.599 . . . . 0.80000000000000004 110.778 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.561 HG22 ' HB2' ' A' ' 820' ' ' ASP . 0.2 OUTLIER -136.93 176.56 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 1.73 110.642 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.24 110.91 27.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.914 0.387 . . . . 1.21 111.138 -179.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 5.9 tt -79.69 124.07 28.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 1.52 110.869 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -69.87 -66.16 2.32 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.812 -0.709 . . . . 1.0900000000000001 112.453 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 830' ' ' SER . . . . . 0.447 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -171.02 -140.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.467 0.175 . . . . 1.8 110.617 -179.912 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.447 ' H ' ' HB3' ' A' ' 830' ' ' SER . 1.9 p30 -58.12 -18.72 27.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.779 0.323 . . . . 2.2000000000000002 111.048 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -72.23 -68.14 0.49 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.261 -0.427 . . . . 2.21 110.715 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.522 ' O ' ' HB2' ' A' ' 837' ' ' ALA . 0.7 OUTLIER -62.88 -12.27 23.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.312 -0.404 . . . . 0.72999999999999998 110.668 179.479 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.641 ' HZ2' HG11 ' A' ' 785' ' ' VAL . 2.1 t-105 -85.23 -41.8 15.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.29999999999999999 110.249 179.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . 0.493 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -68.33 -36.7 79.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.892 -0.594 . . . . 2.8500000000000001 109.489 178.984 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 64.5 t -70.62 -55.27 14.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.354 -0.839 . . . . 1.4399999999999999 109.913 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.522 ' HB2' ' O ' ' A' ' 833' ' ' ASP . . . -57.21 -24.34 53.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.953 -0.567 . . . . 1.04 110.533 179.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 28.7 mtmt -71.42 -49.63 39.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 1.3600000000000001 110.366 179.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 0.5 OUTLIER -61.26 -21.91 64.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.977 -0.556 . . . . 1.95 110.214 179.424 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.6 ttp -77.79 -36.39 50.48 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.704 -0.68 . . . . 1.0900000000000001 110.454 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 17.2 mt -66.1 -48.8 69.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 1.1799999999999999 110.629 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.81 -30.5 71.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.165 -0.47 . . . . 1.1799999999999999 111.097 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 0.7 OUTLIER -69.27 5.86 1.16 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.154 -0.476 . . . . 1.6799999999999999 110.593 179.741 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.461 ' H ' ' C ' ' A' ' 842' ' ' ALA . 9.0 m-80 -143.2 19.36 1.92 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 1.96 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 62.06 9.96 3.4 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.115 -0.493 . . . . 2.4700000000000002 111.346 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.33 174.36 10.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.499 -0.319 . . . . 2.2999999999999998 110.909 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -157.65 -32.63 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 2.46 110.84 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -80.27 147.95 30.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 1.52 110.86 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.531 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.6 OUTLIER -125.01 128.38 48.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 1.3799999999999999 111.011 -179.857 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -79.15 160.08 27.15 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.173 -0.467 . . . . 1.5600000000000001 110.978 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.697 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.1 mm . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.439 -0.346 . . . . 1.73 111.63 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.621 0.248 . . . . 1.75 110.836 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.711 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.24 98.39 1.29 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.043 0.449 . . . . 1.3600000000000001 109.873 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.73 86.97 4.2 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.824 -0.626 . . . . 1.1899999999999999 110.678 -179.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . 0.422 HD21 ' HA ' ' A' ' 783' ' ' LEU . 0.2 OUTLIER -82.11 117.43 22.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.244 -0.889 . . . . 2.1499999999999999 110.991 -179.723 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . 0.554 HD11 ' HD2' ' A' ' 847' ' ' LYS . 0.7 OUTLIER -63.12 110.93 2.0 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.085 0.469 . . . . 1.53 110.299 179.672 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.664 HG12 ' HZ2' ' A' ' 834' ' ' TRP . 46.8 t -107.03 152.78 8.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.708 -0.678 . . . . 1.79 111.703 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.504 ' N ' HG11 ' A' ' 785' ' ' VAL . 1.0 OUTLIER -101.05 172.04 7.26 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.803 -0.635 . . . . 1.3999999999999999 110.416 179.4 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.27 53.24 2.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.962 0.411 . . . . 3.3399999999999999 110.622 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.2 p -164.19 -27.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.991 -0.55 . . . . 1.0900000000000001 111.097 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -53.23 126.01 19.54 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.092 -0.504 . . . . 0.34000000000000002 112.14 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.13 170.11 9.76 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.626 -0.879 . . . . 1.8899999999999999 108.626 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.423 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 49.8 t80 -56.15 -25.27 45.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.97 0.414 . . . . 0.73999999999999999 110.161 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' A' ' 796' ' ' MET . 26.2 t70 -72.6 -59.82 2.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.912 -0.585 . . . . 2.0499999999999998 109.933 178.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.29 -32.68 64.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.284 -0.416 . . . . 1.0700000000000001 110.125 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.31 -53.38 49.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.951 -0.568 . . . . 1.55 110.789 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.679 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 17.4 mm -56.34 -30.81 31.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.768 -0.651 . . . . 1.0800000000000001 111.689 -179.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.53 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 2.6 mtt -68.85 -56.31 8.36 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.234 -0.186 . . . . 2.21 110.964 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -52.03 -51.36 57.95 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.232 0.539 . . . . 1.0900000000000001 110.131 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.489 ' O ' HG12 ' A' ' 802' ' ' ILE . 79.5 mt -58.76 -52.78 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-N 115.505 -0.77 . . . . 1.1799999999999999 110.797 179.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.679 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t-20 -50.49 -31.73 16.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.801 -0.636 . . . . 1.2 111.536 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.54 -34.19 67.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.441 -0.345 . . . . 1.52 110.802 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.54 8.49 44.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 2.73 111.99 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.553 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 3.3 pt -129.14 -19.1 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 111.824 0.305 . . . . 1.4099999999999999 111.824 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.672 ' HG ' ' HA ' ' A' ' 812' ' ' PRO . 1.6 m . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.577 -0.283 . . . . 2.0099999999999998 111.044 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . 0.672 ' HA ' ' HG ' ' A' ' 803' ' ' SER . 35.1 Cg_exo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.856 0.274 . . . . 1.3799999999999999 112.32 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 1.9 mt -109.48 159.58 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 2.4399999999999999 110.8 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 9.5 p -126.42 -51.17 1.51 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.433 -0.348 . . . . 1.73 111.611 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.67 125.68 29.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.9 0.381 . . . . 3.1299999999999999 111.033 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.5 pp -146.59 160.63 10.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 1.52 111.339 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . 0.449 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 16.5 mmtt -102.51 164.12 11.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.995 -0.548 . . . . 1.4299999999999999 110.52 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.485 ' HB2' HD12 ' A' ' 849' ' ' LEU . 12.2 p90 -145.77 153.4 40.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.948 0.404 . . . . 1.24 111.312 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . 0.434 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.6 OUTLIER -76.72 104.76 7.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.924 -0.58 . . . . 2.0899999999999999 110.751 -179.611 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.82 ' HB2' HG21 ' A' ' 826' ' ' VAL . 5.8 t70 -79.26 173.98 12.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.581 -0.736 . . . . 1.8 111.055 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . 0.484 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 6.7 pt-20 -74.1 9.42 1.6 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.14 -0.482 . . . . 1.6200000000000001 111.446 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.72 14.47 29.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.386 -0.37 . . . . 1.6499999999999999 110.802 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 59.07 46.93 93.01 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.751 -0.738 . . . . 0.88 112.376 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -174.5 136.43 0.45 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.025 0.44 . . . . 1.8600000000000001 110.546 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.464 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 91.6 m-85 -63.21 140.7 58.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.751 -0.659 . . . . 0.80000000000000004 110.915 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.82 HG21 ' HB2' ' A' ' 820' ' ' ASP . 2.4 m -130.36 -179.6 3.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.082 -0.508 . . . . 1.73 110.648 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.85 112.7 31.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.05 0.452 . . . . 1.21 111.388 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.401 HD11 ' CE1' ' A' ' 818' ' ' TYR . 0.7 OUTLIER -81.52 123.89 29.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 1.52 110.856 179.892 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -63.5 -65.74 2.91 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.806 -0.711 . . . . 1.0900000000000001 112.443 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 830' ' ' SER . . . . . 0.429 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 2.1 p -173.97 -131.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.241 -0.281 . . . . 1.8 110.241 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.429 ' H ' ' HB2' ' A' ' 830' ' ' SER . 4.8 p-10 -64.03 -14.24 52.82 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.811 0.338 . . . . 2.2000000000000002 110.743 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -69.84 0.43 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.141 -0.482 . . . . 2.21 110.697 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.69 -14.53 14.43 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.149 -0.478 . . . . 0.72999999999999998 110.395 179.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.664 ' HZ2' HG12 ' A' ' 785' ' ' VAL . 1.3 t-105 -81.18 -43.54 19.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.127 -0.488 . . . . 0.29999999999999999 110.094 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . 0.73 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -67.3 -35.93 80.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.025 -0.534 . . . . 2.8500000000000001 109.78 178.927 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . 0.468 HG21 ' ND2' ' A' ' 835' ' ' ASN . 21.8 t -71.22 -55.74 12.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.398 -0.819 . . . . 1.4399999999999999 110.274 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.75 -24.15 55.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.005 -0.543 . . . . 1.04 110.591 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.73 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 31.5 mtmt -71.95 -42.26 66.8 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.163 -0.471 . . . . 1.3600000000000001 110.293 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -65.45 -27.63 68.65 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.103 -0.498 . . . . 1.95 110.014 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 840' ' ' MET . . . . . 0.484 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 12.4 ttp -72.27 -35.13 68.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.743 -0.662 . . . . 1.0900000000000001 110.343 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 846' ' ' GLU . 50.4 mt -70.47 -51.97 25.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.816 -0.629 . . . . 1.1799999999999999 110.811 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.442 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -75.69 -0.63 21.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 1.1799999999999999 111.359 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -65.85 -0.75 2.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.992 0.425 . . . . 1.6799999999999999 110.299 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.442 ' H ' ' C ' ' A' ' 842' ' ' ALA . 69.8 m-80 -150.67 -71.39 0.17 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.852 -0.613 . . . . 1.96 110.507 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.38 27.18 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.885 -0.598 . . . . 2.4700000000000002 111.0 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 841' ' ' LEU . 4.5 mt-10 -87.61 156.29 19.56 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.87 0.367 . . . . 2.2999999999999998 111.038 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . 0.554 ' HD2' HD11 ' A' ' 784' ' ' LEU . 2.9 pttt -145.85 -29.07 0.42 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.039 -0.528 . . . . 2.46 110.956 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.433 ' HE1' HD12 ' A' ' 784' ' ' LEU . 36.6 m-85 -79.8 157.29 27.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.183 -0.462 . . . . 1.52 110.922 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.5 OUTLIER -141.24 126.48 18.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 1.3799999999999999 110.852 179.815 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.434 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 13.9 m120 -77.47 161.2 28.13 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.362 -0.381 . . . . 1.5600000000000001 111.171 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.711 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-N 116.346 -0.388 . . . . 1.73 111.527 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.454 HG23 ' ND2' ' A' ' 850' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.707 0.289 . . . . 1.75 110.973 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.583 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.68 91.11 1.28 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.05 0.452 . . . . 1.3600000000000001 110.113 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.573 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -98.33 92.89 5.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 1.1899999999999999 111.106 -179.414 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.64 157.77 17.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.688 -0.687 . . . . 2.1499999999999999 110.746 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.75 112.78 23.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.417 -0.356 . . . . 1.53 110.381 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.583 HG11 ' N ' ' A' ' 786' ' ' GLU . 23.5 t -107.6 153.63 8.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.035 -0.53 . . . . 1.79 111.515 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.583 ' N ' HG11 ' A' ' 785' ' ' VAL . 0.2 OUTLIER -104.82 175.37 5.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.883 -0.598 . . . . 1.3999999999999999 110.453 179.509 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -90.0 55.63 3.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.991 0.424 . . . . 3.3399999999999999 110.734 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.5 p -168.07 -26.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.052 -0.522 . . . . 1.0900000000000001 111.156 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -52.42 125.42 16.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.34000000000000002 111.767 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.68 169.78 10.23 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.808 -0.812 . . . . 1.8899999999999999 108.808 178.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.428 ' O ' HG12 ' A' ' 795' ' ' ILE . 10.1 t80 -55.62 -25.02 36.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.984 0.421 . . . . 0.73999999999999999 109.912 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.544 ' O ' ' HG3' ' A' ' 796' ' ' MET . 4.6 m-20 -73.22 -61.18 1.91 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.896 -0.593 . . . . 2.0499999999999998 109.679 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.94 -32.05 60.97 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 116.229 -0.441 . . . . 1.0700000000000001 110.321 179.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.452 HD22 ' CE2' ' A' ' 834' ' ' TRP . 23.2 tp -64.42 -52.78 56.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.814 -0.63 . . . . 1.55 110.506 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.649 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 21.2 mm -59.55 -30.83 45.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.697 -0.683 . . . . 1.0800000000000001 111.571 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.544 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 3.2 mtt -68.56 -53.76 20.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.61 0.243 . . . . 2.21 110.736 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.09 -49.57 66.17 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.082 0.467 . . . . 1.0900000000000001 110.285 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.437 HG23 HG12 ' A' ' 802' ' ' ILE . 56.5 mt -60.83 -52.84 56.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.623 -0.717 . . . . 1.1799999999999999 110.546 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.649 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -51.81 -23.71 5.07 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.604 -0.725 . . . . 1.2 111.548 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.46 -33.8 31.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.384 -0.371 . . . . 1.52 110.676 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -94.81 4.17 54.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.061 -0.518 . . . . 2.73 111.454 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.561 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.1 pt -124.6 -35.04 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 111.725 0.269 . . . . 1.4099999999999999 111.725 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.531 ' N ' HG13 ' A' ' 802' ' ' ILE . 23.0 p . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.946 0.403 . . . . 2.0099999999999998 111.071 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 C--O 1.23 0.124 0 CA-C-O 120.794 0.247 . . . . 1.3799999999999999 112.02 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 2.8 pt -147.79 139.07 17.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.309 -0.405 . . . . 2.4399999999999999 111.326 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 72.0 p -114.18 -46.32 3.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 1.73 111.078 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -99.1 127.28 45.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 3.1299999999999999 110.861 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.1 pp -153.82 171.51 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.173 -0.467 . . . . 1.52 111.229 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -101.49 175.07 5.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 1.4299999999999999 110.821 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.642 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 27.5 p90 -145.6 156.75 43.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.225 -0.443 . . . . 1.24 111.08 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . 0.476 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.8 OUTLIER -86.93 106.49 17.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.228 0.537 . . . . 2.0899999999999999 110.59 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -79.4 177.76 8.61 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.426 -0.806 . . . . 1.8 110.886 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . 0.491 ' HG2' ' HG3' ' A' ' 840' ' ' MET . 0.2 OUTLIER -80.69 13.2 2.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.121 -0.49 . . . . 1.6200000000000001 111.088 -179.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -99.75 -11.82 20.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 1.6499999999999999 110.743 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 94.39 11.36 57.28 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.705 -0.759 . . . . 0.88 112.618 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -128.5 -153.49 0.57 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.997 0.427 . . . . 1.8600000000000001 110.612 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.465 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 63.0 m-85 -133.26 134.94 44.58 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.918 -0.583 . . . . 0.80000000000000004 111.195 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.642 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 1.5 t -111.32 173.18 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 116.052 -0.522 . . . . 1.73 110.946 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 6.1 t -99.45 107.06 19.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.797 0.332 . . . . 1.21 111.074 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 7.5 tp -79.76 104.92 10.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 1.52 110.672 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.11 -63.66 3.68 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.831 -0.7 . . . . 1.0900000000000001 112.712 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 830' ' ' SER . . . . . 0.464 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -166.64 -142.45 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.465 0.174 . . . . 1.8 110.571 -179.795 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.464 ' H ' ' HB3' ' A' ' 830' ' ' SER . 4.6 t0 -59.66 -14.1 12.45 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.739 0.304 . . . . 2.2000000000000002 110.925 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -73.8 -70.88 0.35 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.289 -0.414 . . . . 2.21 110.733 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.575 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 9.7 m-20 -63.31 -11.91 25.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.72999999999999998 110.357 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.483 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.5 t-105 -83.1 -39.69 20.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.18 -0.464 . . . . 0.29999999999999999 109.898 179.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . 0.684 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -69.9 -36.36 75.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.893 -0.594 . . . . 2.8500000000000001 109.936 178.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.01 -54.54 16.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.419 -0.81 . . . . 1.4399999999999999 110.296 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.575 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -58.39 -24.85 61.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.099 -0.501 . . . . 1.04 110.462 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.684 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.0 mtmt -69.77 -43.46 72.16 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.101 -0.5 . . . . 1.3600000000000001 110.367 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -64.41 -26.21 68.36 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 1.95 110.031 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 840' ' ' MET . . . . . 0.491 ' HG3' ' HG2' ' A' ' 821' ' ' GLU . 7.6 ttp -72.92 -36.5 67.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.667 -0.697 . . . . 1.0900000000000001 110.155 179.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.631 HD11 HD22 ' A' ' 849' ' ' LEU . 3.2 mt -68.59 -44.28 74.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.585 . . . . 1.1799999999999999 110.773 179.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.475 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.46 -23.51 66.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 1.1799999999999999 111.179 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.8 3.81 1.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 1.6799999999999999 110.591 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.475 ' H ' ' C ' ' A' ' 842' ' ' ALA . 38.6 m-80 -151.31 16.69 0.73 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.968 -0.56 . . . . 1.96 110.692 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 24.0 t30 58.59 19.68 6.91 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.01 -0.541 . . . . 2.4700000000000002 111.102 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.16 161.06 29.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 2.2999999999999998 111.024 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -152.54 10.25 0.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 2.46 110.696 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.573 ' HB3' HG22 ' A' ' 782' ' ' THR . 74.6 m-85 -112.97 125.91 54.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.957 -0.565 . . . . 1.52 110.765 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.631 HD22 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -122.06 119.08 30.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 1.3799999999999999 111.002 -179.688 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.476 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 6.5 m120 -82.17 174.68 10.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 1.5600000000000001 111.178 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.583 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.6 mm . . . . . 0 C--N 1.333 -0.145 0 CA-C-N 116.165 -0.471 . . . . 1.73 111.167 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.448 HG21 HD21 ' A' ' 850' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.757 0.313 . . . . 1.75 110.978 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.655 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -144.21 84.15 1.75 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.254 -0.43 . . . . 1.3600000000000001 109.971 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.3 OUTLIER -98.5 102.64 14.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 1.1899999999999999 111.602 -179.258 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.54 -164.87 1.19 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.009 -0.541 . . . . 2.1499999999999999 110.342 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.04 108.83 15.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.012 0.434 . . . . 1.53 110.151 179.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.462 HG11 ' CE3' ' A' ' 789' ' ' TRP . 90.3 t -101.88 147.11 9.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.664 -0.698 . . . . 1.79 111.155 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -103.98 168.84 8.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.257 -0.429 . . . . 1.3999999999999999 110.953 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.82 56.53 3.93 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.193 0.52 . . . . 3.3399999999999999 110.488 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . 0.404 ' O ' HG21 ' A' ' 788' ' ' VAL . 1.7 p -164.32 -27.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.515 -0.766 . . . . 1.0900000000000001 110.49 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . 0.462 ' CE3' HG11 ' A' ' 785' ' ' VAL . 30.3 m0 -50.52 124.25 10.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.498 -0.774 . . . . 0.34000000000000002 111.897 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . 0.723 HD22 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -93.43 162.62 13.91 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.916 -0.772 . . . . 1.8899999999999999 108.916 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -44.04 -30.18 0.7 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.824 0.345 . . . . 0.73999999999999999 111.395 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.723 ' HB3' HD22 ' A' ' 790' ' ' ASN . 13.1 t0 -76.69 -59.01 2.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.233 -0.44 . . . . 2.0499999999999998 110.143 179.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . 0.593 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 1.4 m-20 -53.12 -21.69 5.21 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.553 0.692 . . . . 1.0700000000000001 109.271 178.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.684 HD11 HD11 ' A' ' 798' ' ' ILE . 1.3 tm? -74.19 -75.58 0.15 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.766 -1.106 . . . . 1.55 109.988 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.615 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 23.4 mm -46.44 -32.38 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.032 -0.985 . . . . 1.0800000000000001 111.98 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.631 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 26.1 mtm -69.93 -42.23 73.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.711 0.291 . . . . 2.21 110.836 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -63.73 -47.68 80.09 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.012 0.434 . . . . 1.0900000000000001 110.101 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.684 HD11 HD11 ' A' ' 794' ' ' LEU . 31.2 mt -62.74 -50.23 80.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.711 -0.677 . . . . 1.1799999999999999 110.176 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.616 HD22 ' H ' ' A' ' 813' ' ' ILE . 1.2 t-20 -52.19 -32.63 37.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.6 -0.727 . . . . 1.2 111.242 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.87 -32.69 65.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 1.52 110.79 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . 0.448 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 4.4 mmtt -88.05 -5.06 58.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.093 -0.503 . . . . 2.73 111.374 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.723 HD13 HG12 ' A' ' 813' ' ' ILE . 1.3 pp -111.79 -21.65 5.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.498 -0.319 . . . . 1.4099999999999999 111.423 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.662 ' HB2' HD11 ' A' ' 802' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.342 -0.39 . . . . 2.0099999999999998 111.085 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo . . . . . 0 C--O 1.231 0.156 0 CA-C-O 120.87 0.279 . . . . 1.3799999999999999 112.392 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.723 HG12 HD13 ' A' ' 802' ' ' ILE . 11.6 pt -135.59 -178.22 2.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 2.4399999999999999 111.084 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 8.9 p -142.73 -66.32 0.39 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.093 -0.503 . . . . 1.73 111.097 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.03 129.68 34.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.148 -0.478 . . . . 3.1299999999999999 110.66 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.3 pp -146.05 161.53 11.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.065 0.459 . . . . 1.52 111.495 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -102.31 160.03 14.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.746 -0.661 . . . . 1.4299999999999999 110.496 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.488 ' HB2' HD11 ' A' ' 849' ' ' LEU . 11.0 p90 -145.31 156.49 43.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.973 0.416 . . . . 1.24 111.307 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -78.59 107.01 10.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.832 -0.622 . . . . 2.0899999999999999 110.738 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.707 ' HB2' HG23 ' A' ' 826' ' ' VAL . 2.7 t0 -78.27 176.41 9.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.631 -0.713 . . . . 1.8 110.578 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -76.04 4.76 7.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.438 . . . . 1.6200000000000001 111.409 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -102.65 16.01 27.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.408 -0.36 . . . . 1.6499999999999999 110.833 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 57.73 50.56 64.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.822 -0.704 . . . . 0.88 112.358 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -173.1 132.89 0.51 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.794 0.331 . . . . 1.8600000000000001 110.635 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.464 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 71.6 m-85 -61.03 142.55 56.54 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.097 -0.501 . . . . 0.80000000000000004 110.682 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.707 HG23 ' HB2' ' A' ' 820' ' ' ASP . 2.4 m -134.66 179.39 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.297 -0.41 . . . . 1.73 111.037 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -99.14 113.11 33.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.969 0.414 . . . . 1.21 111.371 -179.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.24 120.81 24.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.825 -0.625 . . . . 1.52 110.835 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.12 -68.27 1.71 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.844 -0.693 . . . . 1.0900000000000001 112.606 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -170.8 -144.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.485 -0.191 . . . . 1.8 110.485 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -53.77 -25.03 17.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.74 0.305 . . . . 2.2000000000000002 111.081 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -66.59 0.53 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.233 -0.439 . . . . 2.21 110.656 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.514 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 1.6 m-20 -64.22 -12.14 37.89 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.277 -0.42 . . . . 0.72999999999999998 110.348 179.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.439 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 3.6 t-105 -81.88 -40.02 23.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.29999999999999999 109.808 178.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . 0.664 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 11.6 m-80 -71.02 -32.04 68.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 2.8500000000000001 109.883 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 39.7 t -75.34 -53.77 15.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.715 -0.675 . . . . 1.4399999999999999 109.818 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -56.33 -28.11 57.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.996 -0.547 . . . . 1.04 110.315 179.003 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.664 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.1 mtmt -71.86 -48.41 46.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.854 -0.612 . . . . 1.3600000000000001 110.267 179.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.12 -22.49 66.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.944 -0.571 . . . . 1.95 110.104 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 1.2 ttp -77.54 -35.16 53.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.811 -0.631 . . . . 1.0900000000000001 110.266 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.401 HD23 ' HB3' ' A' ' 846' ' ' GLU . 10.2 mt -66.33 -48.86 68.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.917 -0.583 . . . . 1.1799999999999999 110.805 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.465 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.51 -29.69 70.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.414 . . . . 1.1799999999999999 111.017 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -70.63 8.59 0.82 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.984 -0.553 . . . . 1.6799999999999999 110.792 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.465 ' H ' ' C ' ' A' ' 842' ' ' ALA . 40.4 m-80 -148.55 19.63 1.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 1.96 111.005 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 62.77 10.84 4.49 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.206 -0.452 . . . . 2.4700000000000002 111.064 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.401 ' HB3' HD23 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -86.38 147.1 26.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 2.2999999999999998 110.859 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.45 -18.91 1.45 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 2.46 110.931 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -87.96 147.02 25.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.278 -0.419 . . . . 1.52 110.764 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.488 HD11 ' HB2' ' A' ' 818' ' ' TYR . 0.4 OUTLIER -124.03 133.49 53.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.905 0.384 . . . . 1.3799999999999999 111.321 -179.498 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.448 HD21 HG21 ' A' ' 780' ' ' ILE . 8.7 m120 -92.48 157.75 16.4 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.989 -0.55 . . . . 1.5600000000000001 110.747 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.655 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.331 -0.199 0 CA-C-N 116.465 -0.334 . . . . 1.73 111.82 -179.479 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.839 0.352 . . . . 1.75 110.877 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.535 ' HB3' ' CD1' ' A' ' 851' ' ' ILE . 0.0 OUTLIER -150.83 89.72 1.56 Allowed 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.594 -0.521 . . . . 1.3600000000000001 109.594 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.1 OUTLIER -97.99 110.6 23.15 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.816 -0.629 . . . . 1.1899999999999999 111.473 -179.013 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . 0.513 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -110.6 -167.67 1.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.801 -0.636 . . . . 2.1499999999999999 110.606 179.765 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.57 109.24 18.67 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.027 -0.533 . . . . 1.53 110.194 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 27.9 m -105.79 172.73 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 1.79 111.462 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -129.4 158.43 39.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.943 -0.571 . . . . 1.3999999999999999 110.875 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -9.56 51.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 3.3399999999999999 110.959 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.8 p -95.05 -24.97 4.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.884 -0.598 . . . . 1.0900000000000001 110.762 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 27.0 m0 -58.41 124.72 20.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.738 -0.665 . . . . 0.34000000000000002 111.854 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . 0.851 HD22 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -98.06 161.35 13.76 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.916 -0.772 . . . . 1.8899999999999999 108.916 178.394 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.46 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 53.5 t80 -44.36 -33.13 1.54 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.829 0.347 . . . . 0.73999999999999999 111.138 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.851 ' HB3' HD22 ' A' ' 790' ' ' ASN . 35.7 t70 -69.52 -55.21 10.84 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.669 -0.493 . . . . 2.0499999999999998 109.669 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . 0.59 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.6 OUTLIER -58.74 -23.65 60.26 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.167 0.508 . . . . 1.0700000000000001 110.31 179.124 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.473 HD13 ' CZ2' ' A' ' 834' ' ' TRP . 34.5 tp -74.05 -54.35 8.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.62 -0.718 . . . . 1.55 110.367 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.665 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 32.0 mm -57.41 -31.45 38.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.593 -0.73 . . . . 1.0800000000000001 111.74 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.652 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 33.4 mtm -68.14 -50.23 56.0 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.965 -0.294 . . . . 2.21 110.417 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.72 -52.64 61.83 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.026 0.441 . . . . 1.0900000000000001 109.99 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.584 HG12 HD12 ' A' ' 851' ' ' ILE . 68.0 mt -58.68 -51.4 72.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.731 -0.668 . . . . 1.1799999999999999 110.61 179.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.665 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.7 OUTLIER -57.15 -24.39 53.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.61 -0.723 . . . . 1.2 111.199 -179.754 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 34.6 m -79.8 -26.72 40.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.108 -0.496 . . . . 1.52 110.644 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . 0.517 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -98.91 -3.97 33.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.092 -0.503 . . . . 2.73 111.19 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.583 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.2 pt -116.69 -25.52 3.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.76 0.314 . . . . 1.4099999999999999 111.437 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.492 ' N ' HG13 ' A' ' 802' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 2.0099999999999998 111.134 -179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . 0.432 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 46.3 Cg_exo . . . . . 0 CA--C 1.527 0.171 0 CA-C-O 120.754 0.231 . . . . 1.3799999999999999 112.161 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 1.4 pp -138.77 158.16 30.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.296 -0.411 . . . . 2.4399999999999999 111.277 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 29.7 p -115.68 -46.35 2.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.273 -0.422 . . . . 1.73 111.182 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . 0.441 ' O ' HG21 ' A' ' 816' ' ' ILE . 2.3 mmtt -80.73 139.61 36.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 3.1299999999999999 110.706 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . 0.441 HG21 ' O ' ' A' ' 815' ' ' LYS . 0.4 OUTLIER -153.26 175.4 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 121.022 0.439 . . . . 1.52 111.452 -179.848 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . 0.445 ' HE2' HG23 ' A' ' 827' ' ' VAL . 16.2 mmtt -130.88 126.54 36.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.798 -0.637 . . . . 1.4299999999999999 110.188 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.589 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 9.1 p90 -96.74 165.2 12.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.808 0.337 . . . . 1.24 111.057 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . 0.533 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 5.6 tp60 -103.28 113.31 26.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.099 0.475 . . . . 2.0899999999999999 110.576 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -78.96 170.3 16.9 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.556 -0.747 . . . . 1.8 110.941 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.7 9.8 3.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.128 -0.487 . . . . 1.6200000000000001 111.251 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -105.72 6.61 32.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 1.6499999999999999 111.024 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 67.28 57.31 9.5 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.791 -0.719 . . . . 0.88 112.469 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -170.29 131.34 0.96 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.946 0.403 . . . . 1.8600000000000001 110.662 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -72.21 131.21 42.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.882 -0.599 . . . . 0.80000000000000004 110.942 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.589 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -115.14 166.58 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 115.787 -0.642 . . . . 1.73 111.086 -179.64 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . 0.445 HG23 ' HE2' ' A' ' 817' ' ' LYS . 0.2 OUTLIER -99.24 103.49 14.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 1.21 110.618 179.697 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.0 tt -79.5 119.01 21.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.103 -0.499 . . . . 1.52 110.916 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -65.58 -66.46 2.42 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.875 -0.678 . . . . 1.0900000000000001 112.775 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 830' ' ' SER . . . . . 0.49 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 2.5 m -167.54 -135.16 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 110.463 -0.199 . . . . 1.8 110.463 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.49 ' H ' ' HB3' ' A' ' 830' ' ' SER . 1.0 OUTLIER -57.81 -22.46 47.56 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.801 0.334 . . . . 2.2000000000000002 110.941 179.797 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -68.1 -70.05 0.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 2.21 110.877 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.13 -13.91 20.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.35 -0.386 . . . . 0.72999999999999998 110.511 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.502 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 0.4 OUTLIER -80.06 -44.96 19.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.969 -0.56 . . . . 0.29999999999999999 109.941 179.249 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . 0.682 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 18.7 m-80 -68.11 -30.19 69.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.08 -0.509 . . . . 2.8500000000000001 110.061 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 65.1 t -76.39 -56.02 9.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.735 -0.666 . . . . 1.4399999999999999 110.325 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.28 -27.59 64.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.006 -0.543 . . . . 1.04 110.611 179.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.682 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 25.1 mtmt -69.21 -45.27 70.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.183 -0.462 . . . . 1.3600000000000001 110.171 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.99 -26.17 65.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.079 -0.509 . . . . 1.95 110.082 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 19.8 ttp -74.54 -35.32 63.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.632 -0.713 . . . . 1.0900000000000001 110.319 179.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.617 HD22 ' HB3' ' A' ' 846' ' ' GLU . 18.7 mt -66.67 -55.94 12.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.056 -0.52 . . . . 1.1799999999999999 110.646 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.479 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -61.44 -20.3 62.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.038 -0.528 . . . . 1.1799999999999999 111.235 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.13 2.21 1.66 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 1.6799999999999999 110.403 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.479 ' H ' ' C ' ' A' ' 842' ' ' ALA . 54.0 m-80 -153.7 23.15 0.52 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.902 -0.59 . . . . 1.96 110.769 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.9 t30 59.24 21.59 9.77 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.076 -0.511 . . . . 2.4700000000000002 111.036 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.617 ' HB3' HD22 ' A' ' 841' ' ' LEU . 1.5 mt-10 -82.85 142.09 31.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 2.2999999999999998 110.867 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 4.05 4.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 2.46 111.044 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.513 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 4.5 m-85 -104.0 126.17 50.92 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.24 -0.436 . . . . 1.52 110.94 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.5 OUTLIER -119.06 127.66 53.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 1.3799999999999999 111.116 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.533 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 17.2 m-20 -86.0 156.21 20.54 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.962 -0.563 . . . . 1.5600000000000001 110.721 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.584 HD12 HG12 ' A' ' 798' ' ' ILE . 1.7 mt . . . . . 0 C--N 1.332 -0.158 0 CA-C-O 120.753 0.311 . . . . 1.73 111.835 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.756 0.313 . . . . 1.75 110.811 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.775 ' HB3' HD13 ' A' ' 851' ' ' ILE . 0.4 OUTLIER -151.82 93.92 1.91 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.497 -0.557 . . . . 1.3600000000000001 109.497 179.55 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.61 HG21 ' HB3' ' A' ' 848' ' ' PHE . 0.2 OUTLIER -97.89 99.92 11.26 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.608 -0.724 . . . . 1.1899999999999999 111.233 -178.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -106.28 140.9 38.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.602 -0.726 . . . . 2.1499999999999999 110.572 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.47 113.77 12.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.076 0.465 . . . . 1.53 110.489 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.414 HG13 ' HH2' ' A' ' 834' ' ' TRP . 32.7 m -106.1 -163.92 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.516 -0.766 . . . . 1.79 111.152 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -150.06 169.14 21.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.219 -0.446 . . . . 1.3999999999999999 111.132 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . 0.546 ' HB2' ' HZ2' ' A' ' 787' ' ' LYS . 0.0 OUTLIER -79.33 -10.34 59.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 3.3399999999999999 110.917 -179.788 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.6 p -97.64 -28.02 3.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.921 -0.581 . . . . 1.0900000000000001 110.719 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 21.2 m0 -53.36 119.06 4.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.759 -0.655 . . . . 0.34000000000000002 111.565 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.05 168.22 16.12 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.215 -0.661 . . . . 1.8899999999999999 109.215 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -53.4 -25.51 16.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.931 0.396 . . . . 0.73999999999999999 110.199 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.629 ' O ' ' HG3' ' A' ' 796' ' ' MET . 47.1 m-20 -79.97 -57.46 3.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.952 -0.567 . . . . 2.0499999999999998 109.688 178.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.01 -21.72 4.82 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.036 -0.727 . . . . 1.0700000000000001 109.036 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.696 HD12 HD12 ' A' ' 798' ' ' ILE . 1.3 tm? -75.35 -76.44 0.15 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.827 -1.079 . . . . 1.55 110.208 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.627 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 16.3 mm -45.52 -35.67 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.162 -0.926 . . . . 1.0800000000000001 112.072 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.629 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 20.7 mtt -67.91 -48.98 64.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.563 0.22 . . . . 2.21 110.715 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -56.55 -52.81 63.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.112 0.482 . . . . 1.0900000000000001 109.965 179.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.696 HD12 HD12 ' A' ' 794' ' ' LEU . 76.4 mt -56.93 -52.71 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.553 -0.749 . . . . 1.1799999999999999 110.527 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.762 ' HA ' HG12 ' A' ' 802' ' ' ILE . 1.6 t-20 -53.2 -34.29 56.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.412 -0.813 . . . . 1.2 111.372 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 13.3 t -69.18 -30.47 68.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.337 -0.392 . . . . 1.52 110.941 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -88.38 -18.42 28.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 2.73 111.42 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.762 HG12 ' HA ' ' A' ' 799' ' ' ASN . 0.9 OUTLIER -94.8 -23.84 5.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.716 0.293 . . . . 1.4099999999999999 111.355 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.467 ' N ' HG13 ' A' ' 802' ' ' ILE . 94.9 p . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.345 -0.389 . . . . 2.0099999999999998 110.9 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . 0.469 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 31.2 Cg_exo . . . . . 0 CA--C 1.528 0.19 0 CA-C-O 120.779 0.241 . . . . 1.3799999999999999 112.456 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 14.3 mm -115.7 153.91 17.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.123 -0.49 . . . . 2.4399999999999999 110.904 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -124.08 -68.67 0.85 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.437 -0.347 . . . . 1.73 111.462 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.78 129.77 34.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.309 -0.405 . . . . 3.1299999999999999 110.794 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.5 pp -144.75 -178.22 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.211 -0.45 . . . . 1.52 111.409 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 851' ' ' ILE . 15.6 mmtt -121.79 149.92 42.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.983 -0.553 . . . . 1.4299999999999999 110.488 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.692 ' HB2' HD12 ' A' ' 849' ' ' LEU . 0.9 OUTLIER -130.98 165.05 24.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.364 . . . . 1.24 111.299 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.05 109.13 21.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.947 -0.57 . . . . 2.0899999999999999 111.086 -179.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -79.12 167.31 21.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.566 -0.743 . . . . 1.8 110.53 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -70.06 -0.0 6.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.351 -0.386 . . . . 1.6200000000000001 111.443 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.68 13.61 33.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.446 -0.343 . . . . 1.6499999999999999 110.94 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 57.56 57.84 17.71 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.754 -0.736 . . . . 0.88 112.167 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -169.2 131.29 1.2 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 1.8600000000000001 110.708 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.487 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 57.9 m-85 -75.19 134.92 41.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.916 -0.584 . . . . 0.80000000000000004 110.974 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . . . . . . . . . 11.7 m -128.26 -177.91 2.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 1.73 110.69 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . 0.406 HG23 ' HZ1' ' A' ' 817' ' ' LYS . 2.0 t -99.08 103.41 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.025 0.441 . . . . 1.21 111.74 -179.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.462 HD11 ' O ' ' A' ' 833' ' ' ASP . 8.7 tt -107.54 137.64 45.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.764 -0.653 . . . . 1.52 110.379 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -179.76 32.92 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.269 -0.967 . . . . 1.0900000000000001 113.148 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.47 150.68 30.67 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.877 0.339 . . . . 1.8 110.529 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -51.55 -21.93 2.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.014 0.435 . . . . 2.2000000000000002 110.386 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -71.6 -61.76 1.66 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.585 . . . . 2.21 110.967 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.511 ' O ' ' HB2' ' A' ' 837' ' ' ALA . 0.6 OUTLIER -63.45 -17.94 63.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.812 0.339 . . . . 0.72999999999999998 110.157 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.495 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.8 t-105 -82.4 -42.11 19.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.142 -0.481 . . . . 0.29999999999999999 110.425 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . 0.719 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 16.6 m-80 -71.0 -30.87 67.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.098 0.475 . . . . 2.8500000000000001 110.185 179.18 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 91.2 t -75.74 -53.55 15.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.838 -0.619 . . . . 1.4399999999999999 110.011 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.511 ' HB2' ' O ' ' A' ' 833' ' ' ASP . . . -57.84 -26.12 61.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.057 -0.519 . . . . 1.04 110.492 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.719 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 34.3 mtmt -72.46 -42.71 64.67 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.191 -0.459 . . . . 1.3600000000000001 110.32 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -64.38 -26.39 68.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.963 -0.562 . . . . 1.95 110.305 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 9.3 ttp -74.76 -39.26 61.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.791 -0.64 . . . . 1.0900000000000001 110.443 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.593 HD21 ' HB3' ' A' ' 846' ' ' GLU . 63.4 mt -64.49 -42.72 95.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 1.1799999999999999 110.845 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.471 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.0 -28.66 69.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.223 -0.444 . . . . 1.1799999999999999 111.074 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -70.61 6.94 1.23 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 1.6799999999999999 110.58 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.471 ' H ' ' C ' ' A' ' 842' ' ' ALA . 37.0 m-80 -148.1 14.76 1.03 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.042 -0.526 . . . . 1.96 110.911 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 59.19 18.22 6.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 2.4700000000000002 111.14 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.593 ' HB3' HD21 ' A' ' 841' ' ' LEU . 1.7 mm-40 -79.27 169.88 17.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.34 -0.391 . . . . 2.2999999999999998 110.936 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.8 10.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 2.46 111.195 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.61 ' HB3' HG21 ' A' ' 782' ' ' THR . 49.9 m-85 -117.23 131.68 56.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.821 0.343 . . . . 1.52 110.629 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.692 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.4 OUTLIER -110.5 123.74 50.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 1.3799999999999999 111.027 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -83.15 141.35 32.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.125 -0.489 . . . . 1.5600000000000001 110.949 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.775 HD13 ' HB3' ' A' ' 781' ' ' PHE . 1.2 mt . . . . . 0 C--N 1.333 -0.11 0 CA-C-N 116.498 -0.319 . . . . 1.73 111.821 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.528 HG23 ' O ' ' A' ' 851' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.745 0.307 . . . . 1.75 111.053 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.534 ' HB3' ' CD1' ' A' ' 851' ' ' ILE . 0.0 OUTLIER -149.0 89.44 1.67 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.509 -0.552 . . . . 1.3600000000000001 109.509 179.778 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.553 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -97.53 102.2 13.9 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.911 -0.586 . . . . 1.1899999999999999 111.341 -178.889 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . 0.527 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 8.9 mp -89.48 -176.37 5.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.544 -0.753 . . . . 2.1499999999999999 110.637 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.77 95.04 5.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.829 -0.623 . . . . 1.53 109.523 178.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.465 HG12 ' N ' ' A' ' 786' ' ' GLU . 93.8 t -92.76 146.52 6.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.347 -0.842 . . . . 1.79 111.683 -178.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.465 ' N ' HG12 ' A' ' 785' ' ' VAL . 0.1 OUTLIER -102.41 171.04 7.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.817 -0.629 . . . . 1.3999999999999999 110.629 179.688 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.32 53.55 2.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 3.3399999999999999 110.858 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.7 p -163.35 -22.97 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.981 -0.554 . . . . 1.0900000000000001 110.87 -179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 36.6 m0 -57.07 129.55 42.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.766 -0.652 . . . . 0.34000000000000002 112.118 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.16 166.9 11.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.707 -0.849 . . . . 1.8899999999999999 108.707 178.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -54.58 -23.36 16.51 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.746 -0.382 . . . . 0.73999999999999999 110.076 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.545 ' O ' ' HG3' ' A' ' 796' ' ' MET . 10.0 t70 -73.24 -58.36 3.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.912 -0.585 . . . . 2.0499999999999998 109.919 178.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.39 -33.47 69.66 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 116.265 -0.425 . . . . 1.0700000000000001 110.334 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 24.7 tp -61.56 -51.74 67.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.832 -0.622 . . . . 1.55 110.07 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.682 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 17.8 mm -57.76 -31.47 40.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.54 -0.755 . . . . 1.0800000000000001 111.252 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.4 mtp -67.4 -52.19 42.82 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.7 0.286 . . . . 2.21 110.504 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.5 -53.51 50.5 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.172 -0.467 . . . . 1.0900000000000001 110.241 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.408 HD11 HD13 ' A' ' 851' ' ' ILE . 70.3 mt -58.76 -50.16 80.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.772 -0.649 . . . . 1.1799999999999999 110.768 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.682 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.1 t-20 -55.59 -27.91 52.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.702 -0.681 . . . . 1.2 111.248 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 46.9 t -78.62 -26.14 45.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.354 -0.385 . . . . 1.52 110.743 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . 0.514 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -97.65 -2.03 42.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 2.73 111.298 -179.824 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.793 HD13 HG12 ' A' ' 813' ' ' ILE . 1.0 OUTLIER -113.89 -34.2 2.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.733 0.301 . . . . 1.4099999999999999 111.399 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 803' ' ' SER . . . . . 0.56 ' N ' HG13 ' A' ' 802' ' ' ILE . 14.7 p . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 2.0099999999999998 111.159 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . 0.424 ' HA ' HD11 ' A' ' 802' ' ' ILE . 23.1 Cg_exo . . . . . 0 C--O 1.231 0.152 0 CA-C-O 120.786 0.244 . . . . 1.3799999999999999 112.011 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.793 HG12 HD13 ' A' ' 802' ' ' ILE . 7.5 pt -132.86 -175.96 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 2.4399999999999999 111.148 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.84 -67.43 0.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.416 -0.357 . . . . 1.73 111.465 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -79.58 119.36 22.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.421 -0.354 . . . . 3.1299999999999999 110.852 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.81 177.4 7.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.071 0.463 . . . . 1.52 111.562 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 15.1 mmtt -115.47 166.64 11.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.668 -0.696 . . . . 1.4299999999999999 110.111 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.478 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 9.3 p90 -151.58 157.98 42.91 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.042 0.449 . . . . 1.24 111.459 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . 0.49 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 1.6 tt0 -82.78 107.13 15.18 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.819 -0.628 . . . . 2.0899999999999999 110.733 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.751 ' HB2' HG22 ' A' ' 826' ' ' VAL . 12.8 t0 -78.69 178.17 8.07 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.6 -0.727 . . . . 1.8 110.67 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.28 35.49 0.33 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.412 -0.358 . . . . 1.6200000000000001 111.155 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.66 11.96 4.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 1.6499999999999999 110.608 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . 0.459 ' HA2' HE21 ' A' ' 819' ' ' GLN . . . 61.5 47.34 91.22 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.822 -0.704 . . . . 0.88 112.219 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -171.12 133.97 0.9 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.991 0.424 . . . . 1.8600000000000001 110.615 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.478 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 95.2 m-85 -64.12 145.21 56.32 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.891 -0.595 . . . . 0.80000000000000004 110.784 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.751 HG22 ' HB2' ' A' ' 820' ' ' ASP . 0.5 OUTLIER -132.97 177.5 7.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 1.73 110.682 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -99.03 110.39 26.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.886 0.374 . . . . 1.21 111.181 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.536 HD13 ' HB3' ' A' ' 833' ' ' ASP . 6.0 tp -79.93 113.84 18.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.904 -0.589 . . . . 1.52 110.625 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -59.76 -68.88 1.47 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.934 -0.651 . . . . 1.0900000000000001 112.594 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 830' ' ' SER . . . . . 0.457 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.3 OUTLIER -171.41 -142.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.475 0.178 . . . . 1.8 110.538 -179.834 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.457 ' H ' ' HB3' ' A' ' 830' ' ' SER . 10.3 t70 -55.18 -22.61 18.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.69 0.281 . . . . 2.2000000000000002 110.943 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -68.41 -70.85 0.24 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.383 -0.372 . . . . 2.21 110.737 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.536 ' HB3' HD13 ' A' ' 828' ' ' LEU . 0.6 OUTLIER -60.0 -13.34 10.92 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.385 -0.37 . . . . 0.72999999999999998 110.584 179.563 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.524 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.0 OUTLIER -79.86 -45.3 18.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.243 -0.435 . . . . 0.29999999999999999 110.014 179.172 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -67.94 -33.28 74.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.924 -0.58 . . . . 2.8500000000000001 110.224 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 15.7 t -73.92 -52.0 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-N 115.887 -0.597 . . . . 1.4399999999999999 109.879 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.504 ' HB1' ' O ' ' A' ' 833' ' ' ASP . . . -57.97 -26.77 62.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.97 -0.559 . . . . 1.04 110.139 178.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.522 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 0.9 OUTLIER -67.79 -45.97 73.27 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.869 -0.605 . . . . 1.3600000000000001 110.348 179.513 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 0.0 OUTLIER -62.51 -27.76 69.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.1 -0.5 . . . . 1.95 110.225 179.486 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 10.3 ttp -72.21 -36.69 69.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.873 -0.603 . . . . 1.0900000000000001 110.419 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 3.5 mt -73.92 -47.67 36.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.84 -0.618 . . . . 1.1799999999999999 110.833 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.466 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -63.21 -24.45 67.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.065 -0.516 . . . . 1.1799999999999999 111.047 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 14.9 tt0 -65.64 -0.02 1.88 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 1.6799999999999999 110.46 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.466 ' H ' ' C ' ' A' ' 842' ' ' ALA . 9.7 m120 -145.67 17.82 1.47 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.916 -0.584 . . . . 1.96 110.681 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 4.0 m120 59.05 29.79 19.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.5 . . . . 2.4700000000000002 110.887 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -84.34 156.82 21.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 2.2999999999999998 110.831 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -149.13 13.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 2.46 110.995 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.527 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 79.9 m-85 -116.46 116.19 27.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 1.52 110.765 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.553 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.5 OUTLIER -109.44 125.94 52.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.49 . . . . 1.3799999999999999 111.246 -179.615 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.49 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 9.6 m-20 -79.69 160.64 26.21 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.91 -0.587 . . . . 1.5600000000000001 111.062 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.534 ' CD1' ' HB3' ' A' ' 781' ' ' PHE . 17.7 mt . . . . . 0 C--N 1.333 -0.119 0 CA-C-N 116.49 -0.323 . . . . 1.73 111.628 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.499 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.856 0.36 . . . . 1.75 111.101 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.458 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -149.06 87.02 1.52 Allowed 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.272 -0.422 . . . . 1.3600000000000001 110.194 179.803 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.524 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -98.58 109.93 22.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.872 -0.604 . . . . 1.1899999999999999 111.31 -179.416 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -115.47 -167.99 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.861 -0.609 . . . . 2.1499999999999999 110.726 179.862 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.6 104.28 10.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.956 -0.566 . . . . 1.53 110.161 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 34.7 m -96.7 175.58 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.035 -0.53 . . . . 1.79 111.206 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.66 162.68 26.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.066 -0.516 . . . . 1.3999999999999999 110.764 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.69 2.95 10.67 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.291 -0.413 . . . . 3.3399999999999999 110.889 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.3 p -109.71 -22.9 4.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.521 . . . . 1.0900000000000001 110.689 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -59.17 123.64 17.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.77 -0.65 . . . . 0.34000000000000002 111.902 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . 0.691 HD22 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -96.49 159.76 14.76 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.854 -0.795 . . . . 1.8899999999999999 108.854 178.188 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.42 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 52.0 t80 -42.68 -34.6 0.93 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.646 0.26 . . . . 0.73999999999999999 111.29 -178.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.691 ' HB3' HD22 ' A' ' 790' ' ' ASN . 3.7 t0 -68.85 -55.78 10.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.835 -0.432 . . . . 2.0499999999999998 109.835 178.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . 0.558 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 1.0 OUTLIER -56.08 -25.4 45.29 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.218 0.532 . . . . 1.0700000000000001 109.961 179.078 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.471 HD12 ' CZ2' ' A' ' 834' ' ' TRP . 37.0 tp -71.93 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.396 -0.82 . . . . 1.55 110.241 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.644 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 42.2 mm -55.46 -28.17 22.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.565 -0.743 . . . . 1.0800000000000001 111.541 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.577 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 14.6 mtp -68.26 -50.95 50.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.652 0.263 . . . . 2.21 110.45 179.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -55.52 -53.46 56.15 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.026 0.441 . . . . 1.0900000000000001 110.041 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.57 HD13 HD12 ' A' ' 851' ' ' ILE . 64.3 mt -56.75 -49.74 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.807 -0.633 . . . . 1.1799999999999999 110.557 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.644 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -54.66 -28.26 45.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.7 -0.682 . . . . 1.2 111.273 -179.724 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 35.9 t -78.32 -27.1 47.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.41 -0.359 . . . . 1.52 110.985 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -99.29 0.87 43.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 2.73 111.439 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.582 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.7 pp -117.34 -32.14 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.696 0.284 . . . . 1.4099999999999999 111.397 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 64.0 p . . . . . 0 C--N 1.329 -0.285 0 CA-C-O 120.922 0.391 . . . . 2.0099999999999998 110.981 -179.721 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 C--O 1.232 0.198 0 CA-C-O 120.738 0.224 . . . . 1.3799999999999999 112.426 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.5 HD13 ' H ' ' A' ' 813' ' ' ILE . 0.2 OUTLIER -114.02 172.94 3.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 2.4399999999999999 111.079 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 31.2 p -126.85 -48.44 1.5 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 1.73 111.158 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.5 mptt -80.69 132.05 35.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 3.1299999999999999 110.772 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.1 pp -147.33 174.19 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.43 . . . . 1.52 111.166 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . 0.432 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 16.1 mmtt -120.44 145.33 47.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.038 -0.528 . . . . 1.4299999999999999 110.752 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.537 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 6.0 p90 -124.72 168.54 13.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 1.24 110.996 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -91.38 107.76 19.42 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.042 -0.526 . . . . 2.0899999999999999 110.798 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . 0.735 ' HB2' HG22 ' A' ' 826' ' ' VAL . 3.9 t70 -78.73 168.87 19.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.691 -0.686 . . . . 1.8 110.641 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . 0.401 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.6 OUTLIER -71.48 4.24 3.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.243 -0.435 . . . . 1.6200000000000001 111.361 -179.626 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -99.88 17.0 21.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.398 -0.365 . . . . 1.6499999999999999 110.742 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 55.9 50.51 60.83 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.848 -0.691 . . . . 0.88 112.333 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -172.97 134.6 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.928 0.394 . . . . 1.8600000000000001 110.454 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.537 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 69.3 m-85 -65.76 140.01 58.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.022 -0.536 . . . . 0.80000000000000004 110.666 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.735 HG22 ' HB2' ' A' ' 820' ' ' ASP . 3.1 m -132.48 177.24 7.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 1.73 110.589 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.67 116.17 40.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.049 0.452 . . . . 1.21 111.447 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.76 108.05 13.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.682 -0.69 . . . . 1.52 110.631 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -53.22 -67.14 2.28 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.928 -0.653 . . . . 1.0900000000000001 112.705 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 5.7 p -170.93 -141.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.488 -0.19 . . . . 1.8 110.488 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.32 -23.82 39.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.764 0.316 . . . . 2.2000000000000002 110.874 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.17 -67.94 0.41 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.445 . . . . 2.21 110.674 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.496 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 0.2 OUTLIER -63.05 -13.29 33.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.345 -0.389 . . . . 0.72999999999999998 110.318 179.492 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.536 ' O ' ' HD3' ' A' ' 838' ' ' LYS . 1.6 t-105 -80.46 -40.8 25.55 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.716 -0.476 . . . . 0.29999999999999999 109.716 178.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 31.4 m-80 -76.49 -26.67 55.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.803 -0.635 . . . . 2.8500000000000001 110.132 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . 0.447 HG11 ' N ' ' A' ' 837' ' ' ALA . 0.3 OUTLIER -79.4 -42.76 23.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.831 -0.622 . . . . 1.4399999999999999 109.737 179.327 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -63.74 -30.19 71.32 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.159 0.504 . . . . 1.04 109.823 178.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.536 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 0.6 OUTLIER -66.7 -48.22 69.94 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.631 -0.713 . . . . 1.3600000000000001 110.447 179.416 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -60.15 -27.63 67.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.066 -0.516 . . . . 1.95 110.512 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 840' ' ' MET . . . . . 0.401 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 8.0 ttp -72.89 -38.21 67.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.952 -0.567 . . . . 1.0900000000000001 110.487 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.463 HD22 ' HB3' ' A' ' 846' ' ' GLU . 7.8 mt -72.77 -18.03 61.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 1.1799999999999999 110.905 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.456 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.92 -29.21 44.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 1.1799999999999999 111.339 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.11 1.08 1.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 1.6799999999999999 110.752 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.456 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.1 OUTLIER -144.82 13.31 1.49 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 1.96 110.855 -179.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 58.4 18.83 5.89 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.156 -0.475 . . . . 2.4700000000000002 111.065 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . 0.463 ' HB3' HD22 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -75.25 166.66 23.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 2.2999999999999998 110.901 179.904 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.16 16.38 0.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 2.46 111.02 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.434 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 68.6 m-85 -112.48 113.11 25.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 1.52 110.723 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.524 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.2 OUTLIER -100.9 130.58 46.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 1.3799999999999999 110.937 -179.75 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.466 ' C ' HG12 ' A' ' 851' ' ' ILE . 3.7 m-20 -96.11 153.98 17.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.187 -0.461 . . . . 1.5600000000000001 111.324 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.57 HD12 HD13 ' A' ' 798' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--N 1.332 -0.16 0 CA-C-N 116.069 -0.514 . . . . 1.73 111.066 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.536 HG23 ' HB3' ' A' ' 850' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.766 0.317 . . . . 1.75 110.881 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 781' ' ' PHE . . . . . 0.558 ' HB3' ' CD1' ' A' ' 851' ' ' ILE . 0.3 OUTLIER -142.09 83.65 1.85 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.665 -0.494 . . . . 1.3600000000000001 109.665 179.586 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 782' ' ' THR . . . . . 0.593 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.9 OUTLIER -98.12 123.44 42.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.743 -0.662 . . . . 1.1899999999999999 111.43 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.78 -165.54 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.693 -0.685 . . . . 2.1499999999999999 110.699 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -117.1 104.17 10.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.184 -0.462 . . . . 1.53 110.271 179.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 33.8 m -97.66 -174.75 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.963 -0.562 . . . . 1.79 111.59 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 786' ' ' GLU . . . . . 0.446 ' HG2' HG13 ' A' ' 788' ' ' VAL . 1.1 tt0 -139.22 162.37 35.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.925 -0.58 . . . . 1.3999999999999999 110.759 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 787' ' ' LYS . . . . . 0.435 ' HA ' ' HD2' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -70.92 -7.95 49.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 3.3399999999999999 111.001 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 788' ' ' VAL . . . . . 0.446 HG13 ' HG2' ' A' ' 786' ' ' GLU . 3.0 p -100.33 -25.92 3.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.989 -0.551 . . . . 1.0900000000000001 110.955 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -56.29 121.91 10.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.955 -0.566 . . . . 0.34000000000000002 111.739 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -90.98 165.56 13.48 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.865 -0.791 . . . . 1.8899999999999999 108.865 178.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 791' ' ' PHE . . . . . 0.422 ' O ' HG12 ' A' ' 795' ' ' ILE . 53.3 t80 -52.04 -27.51 13.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.986 0.422 . . . . 0.73999999999999999 110.089 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 792' ' ' ASP . . . . . 0.594 ' O ' ' HG3' ' A' ' 796' ' ' MET . 11.5 m-20 -69.43 -59.71 2.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.568 . . . . 2.0499999999999998 109.815 178.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.14 -32.91 62.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.149 -0.478 . . . . 1.0700000000000001 110.261 179.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.507 HD13 ' CZ2' ' A' ' 834' ' ' TRP . 34.1 tp -62.41 -54.37 41.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.809 -0.632 . . . . 1.55 110.0 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 795' ' ' ILE . . . . . 0.658 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 31.3 mm -58.02 -31.53 41.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.42 -0.809 . . . . 1.0800000000000001 111.696 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 796' ' ' MET . . . . . 0.594 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 20.3 mtt -65.94 -47.8 73.48 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.965 -0.294 . . . . 2.21 110.814 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -56.54 -55.54 32.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.104 0.478 . . . . 1.0900000000000001 109.903 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.557 HD13 HD11 ' A' ' 851' ' ' ILE . 88.6 mt -55.48 -52.49 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.644 -0.707 . . . . 1.1799999999999999 110.628 178.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 799' ' ' ASN . . . . . 0.658 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.5 OUTLIER -55.57 -32.14 62.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.609 -0.723 . . . . 1.2 111.538 -179.56 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.76 -19.3 57.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.887 0.375 . . . . 1.52 110.868 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 801' ' ' LYS . . . . . 0.435 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.1 OUTLIER -106.93 -0.69 22.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.114 -0.494 . . . . 2.73 111.478 -179.907 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 802' ' ' ILE . . . . . 0.58 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.9 pp -119.49 -25.42 2.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.755 0.312 . . . . 1.4099999999999999 111.511 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 93.0 p . . . . . 0 C--N 1.33 -0.267 0 CA-C-O 120.972 0.415 . . . . 2.0099999999999998 111.082 -179.815 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 812' ' ' PRO . . . . . 0.405 ' HB3' HD22 ' A' ' 799' ' ' ASN . 35.6 Cg_exo . . . . . 0 C--O 1.231 0.153 0 CA-C-O 120.864 0.277 . . . . 1.3799999999999999 112.285 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 813' ' ' ILE . . . . . 0.515 HG13 HD12 ' A' ' 802' ' ' ILE . 1.2 pp -133.13 -175.78 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 2.4399999999999999 111.201 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.02 -50.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 1.73 111.111 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -99.3 117.41 33.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.265 -0.425 . . . . 3.1299999999999999 110.909 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.62 178.9 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.109 -0.496 . . . . 1.52 111.28 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 817' ' ' LYS . . . . . 0.433 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 19.5 mttt -117.92 163.71 16.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.955 -0.566 . . . . 1.4299999999999999 110.295 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 818' ' ' TYR . . . . . 0.63 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 20.1 p90 -132.93 158.6 42.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.881 0.372 . . . . 1.24 111.145 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 819' ' ' GLN . . . . . 0.692 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 2.3 tp60 -96.2 108.02 20.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.18 0.514 . . . . 2.0899999999999999 110.327 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -79.33 174.82 11.18 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.564 -0.744 . . . . 1.8 110.882 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.8 40.28 0.59 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.101 -0.5 . . . . 1.6200000000000001 111.116 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -140.11 11.76 2.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 1.6499999999999999 110.618 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 61.69 56.23 24.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.83 -0.7 . . . . 0.88 112.338 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -169.99 132.96 1.14 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.956 0.408 . . . . 1.8600000000000001 110.82 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 825' ' ' PHE . . . . . 0.469 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 77.0 m-85 -77.43 129.04 35.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.886 -0.597 . . . . 0.80000000000000004 110.958 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 826' ' ' VAL . . . . . 0.63 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 0.9 OUTLIER -107.65 167.69 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 116.106 -0.497 . . . . 1.73 111.057 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.67 104.48 16.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.267 -0.424 . . . . 1.21 111.055 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 2.2 tt -80.21 125.64 30.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.035 -0.53 . . . . 1.52 110.782 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -81.31 -56.59 2.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.784 -0.722 . . . . 1.0900000000000001 112.775 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 50.6 p -171.28 -141.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.415 -0.217 . . . . 1.8 110.415 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 10.4 p-10 -57.58 -15.43 7.34 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.648 0.261 . . . . 2.2000000000000002 110.908 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -68.48 -76.32 0.09 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.313 -0.403 . . . . 2.21 110.699 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 833' ' ' ASP . . . . . 0.602 ' O ' ' HB1' ' A' ' 837' ' ' ALA . 0.1 OUTLIER -62.68 -11.49 17.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.34 -0.391 . . . . 0.72999999999999998 110.365 179.541 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 834' ' ' TRP . . . . . 0.507 ' CZ2' HD13 ' A' ' 794' ' ' LEU . 1.4 t-105 -79.95 -38.53 32.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.138 0.494 . . . . 0.29999999999999999 109.931 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 835' ' ' ASN . . . . . 0.669 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -76.14 -34.28 59.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.768 -0.651 . . . . 2.8500000000000001 110.005 179.018 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -72.18 -43.93 65.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.484 -0.78 . . . . 1.4399999999999999 109.861 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 837' ' ' ALA . . . . . 0.602 ' HB1' ' O ' ' A' ' 833' ' ' ASP . . . -69.0 -25.25 64.42 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.207 -0.451 . . . . 1.04 110.115 178.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 838' ' ' LYS . . . . . 0.669 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 30.3 mtmt -72.91 -40.9 65.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.958 -0.565 . . . . 1.3600000000000001 110.066 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 -64.68 -31.48 72.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.97 -0.559 . . . . 1.95 110.039 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 10.2 ttp -67.81 -38.96 83.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.829 -0.623 . . . . 1.0900000000000001 110.14 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 841' ' ' LEU . . . . . 0.434 HD11 HD21 ' A' ' 849' ' ' LEU . 47.1 mt -69.61 -37.68 76.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.82 -0.627 . . . . 1.1799999999999999 110.725 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 842' ' ' ALA . . . . . 0.452 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -67.8 -29.69 68.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 1.1799999999999999 111.083 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -67.31 1.89 1.95 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.114 -0.493 . . . . 1.6799999999999999 110.614 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 844' ' ' ASN . . . . . 0.452 ' H ' ' C ' ' A' ' 842' ' ' ALA . 13.6 m120 -142.76 17.18 1.98 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 1.96 110.928 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 59.51 15.87 4.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.177 -0.465 . . . . 2.4700000000000002 111.041 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -79.75 166.25 21.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 2.2999999999999998 110.85 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.01 12.46 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 2.46 110.949 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 848' ' ' PHE . . . . . 0.593 ' HB3' HG22 ' A' ' 782' ' ' THR . 5.2 m-85 -108.3 127.63 54.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 1.52 110.973 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 849' ' ' LEU . . . . . 0.581 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.4 OUTLIER -118.28 128.98 55.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.151 -0.477 . . . . 1.3799999999999999 110.973 -179.798 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 850' ' ' ASN . . . . . 0.692 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 6.7 m120 -89.22 167.32 13.19 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.948 -0.569 . . . . 1.5600000000000001 111.313 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 851' ' ' ILE . . . . . 0.558 ' CD1' ' HB3' ' A' ' 781' ' ' PHE . 53.3 mt . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.404 -0.362 . . . . 1.73 111.314 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.126 0 N-CA-C 112.447 -0.261 . . . . 9.4199999999999999 112.447 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -92.11 -0.24 57.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.763 0.316 . . . . 8.4800000000000004 111.218 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 73.9 mmm -90.31 -42.25 11.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 8.6400000000000006 111.035 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 90.11 111.18 1.42 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.761 -0.733 . . . . 4.2800000000000002 112.493 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 779' ' ' SER . . . . . 0.483 ' HB2' HD12 ' A' ' 853' ' ' LEU . 0.6 OUTLIER -128.96 163.02 26.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.827 0.346 . . . . 3.0 111.055 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.507 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 1.1 mt -120.84 165.02 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 1.75 110.927 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.713 ' HB2' ' HB ' ' A' ' 851' ' ' ILE . 0.7 OUTLIER -143.39 84.72 1.82 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.268 -0.423 . . . . 1.3600000000000001 110.366 179.735 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.584 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -98.0 103.28 15.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.905 -0.589 . . . . 1.1899999999999999 110.6 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . 0.552 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.1 OUTLIER -112.56 -166.44 1.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.626 -0.715 . . . . 2.1499999999999999 110.732 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.79 112.06 19.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.056 -0.52 . . . . 1.53 110.035 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 10.1 m -103.67 157.1 5.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.998 -0.546 . . . . 1.79 111.138 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.591 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 4.1 tp10 -102.8 170.45 7.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 1.3999999999999999 110.978 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . 0.591 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.4 OUTLIER -83.65 27.04 0.64 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 3.3399999999999999 110.6 179.752 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -136.58 -25.44 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.932 -0.576 . . . . 1.0900000000000001 110.57 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -52.6 123.15 10.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.702 -0.681 . . . . 0.34000000000000002 111.939 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.98 166.03 12.9 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.733 -0.84 . . . . 1.8899999999999999 108.733 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.478 ' O ' HG12 ' A' ' 795' ' ' ILE . 93.0 t80 -52.71 -28.46 22.05 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.693 -0.403 . . . . 0.73999999999999999 110.165 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.47 ' O ' ' HG3' ' A' ' 796' ' ' MET . 14.6 t70 -68.75 -56.24 8.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.07 -0.514 . . . . 2.0499999999999998 109.702 178.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . 0.509 ' HA ' ' HG3' ' A' ' 796' ' ' MET . 1.2 t0 -57.44 -33.05 67.52 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.969 -0.56 . . . . 1.0700000000000001 110.232 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.51 HD13 ' CZ2' ' A' ' 834' ' ' TRP . 30.5 tp -63.69 -53.16 55.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.864 -0.607 . . . . 1.55 109.91 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.649 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 35.8 mm -56.62 -27.01 24.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.645 -0.707 . . . . 1.0800000000000001 111.23 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.509 ' HG3' ' HA ' ' A' ' 793' ' ' ASP . 10.5 mtp -67.66 -46.95 70.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.724 0.297 . . . . 2.21 110.458 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . 0.425 ' O ' ' HD3' ' A' ' 801' ' ' LYS . . . -56.87 -53.68 55.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.037 0.446 . . . . 1.0900000000000001 109.935 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.41 HG21 HD11 ' A' ' 813' ' ' ILE . 75.4 mt -57.95 -51.44 70.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.746 -0.661 . . . . 1.1799999999999999 110.616 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.649 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t-20 -56.27 -26.96 53.65 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.519 -0.764 . . . . 1.2 111.325 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 800' ' ' SER . . . . . 0.502 ' HA ' ' HB2' ' A' ' 804' ' ' ASN . 0.1 OUTLIER -80.11 -23.47 41.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.317 -0.401 . . . . 1.52 110.614 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . 0.425 ' HD3' ' O ' ' A' ' 797' ' ' ALA . 0.5 OUTLIER -101.08 -1.67 33.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.952 -0.567 . . . . 2.73 111.179 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.756 HD11 HG12 ' A' ' 813' ' ' ILE . 1.4 pp -117.14 -29.42 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.453 -0.34 . . . . 1.4099999999999999 111.349 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.408 ' N ' HG13 ' A' ' 802' ' ' ILE . 0.5 OUTLIER -166.03 85.05 0.32 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.283 -0.417 . . . . 2.0099999999999998 110.871 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . 0.502 ' HB2' ' HA ' ' A' ' 800' ' ' SER . 8.6 t-20 -122.01 -17.07 7.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.475 . . . . 3.3900000000000001 110.925 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.05 134.36 33.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 4.5899999999999999 111.212 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -101.82 103.15 13.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 8.4399999999999995 110.888 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -118.09 -70.53 0.79 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.051 -0.522 . . . . 6.8600000000000003 110.765 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -132.63 -73.47 0.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.058 -0.519 . . . . 7.4100000000000001 110.678 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -130.91 136.87 48.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.907 -0.588 . . . . 7.1100000000000003 110.628 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 1.6 pt -121.54 160.57 22.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 5.1699999999999999 111.418 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.21 95.14 10.64 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 2.2000000000000002 110.689 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.83 -176.29 2.27 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.556 2.171 . . . . 1.3799999999999999 112.486 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.756 HG12 HD11 ' A' ' 802' ' ' ILE . 4.4 pt -145.05 171.87 5.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.122 -0.49 . . . . 2.4399999999999999 110.931 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 3.2 p -144.57 -53.81 0.32 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.319 -0.401 . . . . 1.73 111.271 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -81.98 114.92 20.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 3.1299999999999999 110.767 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.08 169.27 20.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.232 -0.44 . . . . 1.52 111.318 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.445 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 8.9 mttt -110.58 166.68 10.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.025 -0.534 . . . . 1.4299999999999999 110.421 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.592 ' HB2' HD12 ' A' ' 849' ' ' LEU . 10.6 p90 -149.77 152.94 36.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.973 0.416 . . . . 1.24 111.377 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.74 108.01 9.45 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.933 -0.576 . . . . 2.0899999999999999 110.672 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.841 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.0 t70 -78.97 179.3 7.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.383 -0.826 . . . . 1.8 110.792 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.71 35.96 0.53 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 1.6200000000000001 111.051 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.33 16.27 3.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.32 -0.4 . . . . 1.6499999999999999 110.999 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 60.98 46.45 94.55 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.787 -0.721 . . . . 0.88 112.319 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -174.02 134.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.972 0.415 . . . . 1.8600000000000001 110.65 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.411 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 72.5 m-85 -65.7 144.97 56.58 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.944 -0.571 . . . . 0.80000000000000004 110.766 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.841 HG22 ' HB2' ' A' ' 820' ' ' ASP . 1.0 OUTLIER -130.03 179.56 4.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 1.73 110.903 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.7 113.57 33.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.981 0.42 . . . . 1.21 111.397 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.97 131.5 34.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.804 -0.634 . . . . 1.52 110.725 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -76.76 -68.52 1.51 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.723 -0.751 . . . . 1.0900000000000001 112.669 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 90.7 p -170.17 -137.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.38 -0.23 . . . . 1.8 110.38 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -54.45 -27.93 40.81 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.907 0.384 . . . . 2.2000000000000002 110.65 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.92 -68.41 0.35 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.08 -0.509 . . . . 2.21 110.882 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' A' ' 837' ' ' ALA . 0.6 OUTLIER -64.1 -11.28 28.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.3 -0.409 . . . . 0.72999999999999998 110.674 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.51 ' CZ2' HD13 ' A' ' 794' ' ' LEU . 1.5 t-105 -82.86 -41.65 18.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.29999999999999999 110.176 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 54.9 m-20 -73.42 -27.33 61.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.048 -0.524 . . . . 2.8500000000000001 110.001 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 51.0 t -78.84 -51.42 17.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.771 -0.65 . . . . 1.4399999999999999 109.928 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.457 ' HB2' ' O ' ' A' ' 833' ' ' ASP . . . -58.13 -30.45 66.34 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.991 -0.55 . . . . 1.04 110.314 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.45 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 1.7 mtpp -67.16 -49.34 65.09 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.877 -0.602 . . . . 1.3600000000000001 110.467 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.88 -24.77 66.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 1.95 110.334 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.9 ttp -75.56 -34.05 60.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.84 -0.618 . . . . 1.0900000000000001 110.37 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 27.8 mt -69.98 -47.42 62.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.915 -0.584 . . . . 1.1799999999999999 110.803 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.45 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.53 -3.64 44.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 1.1799999999999999 111.404 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -3.49 2.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.971 0.415 . . . . 1.6799999999999999 110.171 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.45 ' H ' ' C ' ' A' ' 842' ' ' ALA . 1.5 m120 -145.35 -73.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.771 -0.649 . . . . 1.96 110.322 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -179.26 27.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.833 -0.622 . . . . 2.4700000000000002 110.921 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.22 142.96 30.98 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.291 -0.413 . . . . 2.2999999999999998 110.913 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -132.91 -16.65 2.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.947 -0.569 . . . . 2.46 110.698 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.552 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 32.7 m-85 -84.46 144.9 28.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.171 -0.468 . . . . 1.52 111.133 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.592 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.5 OUTLIER -124.42 131.19 53.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.935 -0.575 . . . . 1.3799999999999999 110.516 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.462 ' C ' HG12 ' A' ' 851' ' ' ILE . 10.5 m120 -89.87 153.58 20.53 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.885 -0.598 . . . . 1.5600000000000001 111.185 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.713 ' HB ' ' HB2' ' A' ' 781' ' ' PHE . 1.5 mm -137.12 159.0 36.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 116.123 -0.49 . . . . 1.73 111.413 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -128.16 163.88 23.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.818 0.342 . . . . 5.6399999999999997 110.782 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . 0.483 HD12 ' HB2' ' A' ' 779' ' ' SER . 32.5 mt -128.69 78.01 1.82 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 2.8900000000000001 110.852 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.233 -0.889 . . . . 3.3900000000000001 110.903 179.949 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.51 -0.236 . . . . 9.4199999999999999 112.51 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -89.83 175.95 7.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.773 0.32 . . . . 8.4800000000000004 111.14 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.53 148.65 40.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 8.6400000000000006 110.818 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -133.1 -152.48 6.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.648 -0.787 . . . . 4.2800000000000002 112.492 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 779' ' ' SER . . . . . 0.419 ' O ' ' HB3' ' A' ' 853' ' ' LEU . 0.0 OUTLIER -148.51 -169.99 3.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.723 0.297 . . . . 3.0 111.047 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.53 -172.6 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 1.75 110.949 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.611 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.3 OUTLIER -153.77 92.05 1.52 Allowed 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.053 0.454 . . . . 1.3600000000000001 110.006 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.552 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -97.43 97.93 9.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.736 -0.666 . . . . 1.1899999999999999 110.89 -179.349 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . 0.529 HD13 ' HZ3' ' A' ' 801' ' ' LYS . 0.5 OUTLIER -91.56 146.73 23.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.595 -0.73 . . . . 2.1499999999999999 111.086 -179.671 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.78 108.98 12.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.404 . . . . 1.53 110.555 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.411 HG12 ' CH2' ' A' ' 834' ' ' TRP . 17.3 m -98.48 -166.6 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.898 -0.592 . . . . 1.79 111.371 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.497 ' HG2' HG12 ' A' ' 788' ' ' VAL . 0.8 OUTLIER -140.37 171.55 13.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.278 -0.419 . . . . 1.3999999999999999 111.003 -179.856 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.03 20.15 2.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 3.3399999999999999 110.853 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . 0.497 HG12 ' HG2' ' A' ' 786' ' ' GLU . 1.7 p -136.18 -26.33 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.777 -0.647 . . . . 1.0900000000000001 110.72 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 24.5 m0 -51.92 126.63 18.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.935 -0.575 . . . . 0.34000000000000002 111.848 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . 0.403 HD21 ' H ' ' A' ' 793' ' ' ASP . 0.0 OUTLIER -93.11 168.67 10.96 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.051 -0.722 . . . . 1.8899999999999999 109.051 178.313 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.409 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 69.8 t80 -54.4 -24.75 21.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.011 0.434 . . . . 0.73999999999999999 110.06 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.619 ' O ' ' HG3' ' A' ' 796' ' ' MET . 26.3 t0 -73.19 -61.78 1.7 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.803 -0.635 . . . . 2.0499999999999998 109.851 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . 0.403 ' H ' HD21 ' A' ' 790' ' ' ASN . 3.0 m-20 -54.01 -27.35 31.31 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.159 -0.473 . . . . 1.0700000000000001 110.045 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 32.1 tp -68.55 -58.12 4.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.783 -0.644 . . . . 1.55 110.403 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.685 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 19.9 mm -56.86 -32.24 38.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.521 -0.763 . . . . 1.0800000000000001 111.647 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.619 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.5 mtt -66.81 -52.87 38.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.7 0.286 . . . . 2.21 110.601 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.89 -54.94 31.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.022 0.439 . . . . 1.0900000000000001 110.192 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.677 HD11 HD13 ' A' ' 851' ' ' ILE . 46.6 mt -56.26 -48.77 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.763 -0.653 . . . . 1.1799999999999999 110.52 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.685 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.2 t-20 -57.96 -23.84 55.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.871 -0.604 . . . . 1.2 111.099 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.81 -24.21 38.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.031 0.444 . . . . 1.52 110.316 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . 0.529 ' HZ3' HD13 ' A' ' 783' ' ' LEU . 0.0 OUTLIER -101.85 -2.34 30.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.766 -0.652 . . . . 2.73 111.297 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.559 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.8 pp -121.2 -25.11 2.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.79 0.328 . . . . 1.4099999999999999 111.414 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 44.1 t -133.6 11.43 4.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.285 -0.416 . . . . 2.0099999999999998 110.825 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 56.74 -163.61 0.17 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.064 -0.516 . . . . 3.3900000000000001 111.035 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 1.9 p -83.79 -27.59 28.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 4.5899999999999999 110.985 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -113.18 139.39 48.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 8.4399999999999995 110.828 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -98.18 110.39 22.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 6.8600000000000003 111.072 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -110.47 63.55 0.61 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.507 . . . . 7.4100000000000001 110.717 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 57.35 55.5 5.77 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.048 -0.524 . . . . 7.1100000000000003 110.854 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -116.68 -11.6 11.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.096 -0.502 . . . . 5.1699999999999999 111.042 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 59.79 94.87 0.05 OUTLIER Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.992 -0.549 . . . . 2.2000000000000002 111.134 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . 0.408 ' HB3' HD22 ' A' ' 799' ' ' ASN . 31.6 Cg_exo -59.18 -169.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.819 2.346 . . . . 1.3799999999999999 112.269 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.405 HG12 HD11 ' A' ' 802' ' ' ILE . 42.2 pt -136.22 154.68 33.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.9 0.381 . . . . 2.4399999999999999 111.436 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 9.8 p -133.44 -64.23 0.73 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.969 -0.559 . . . . 1.73 110.824 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.44 123.38 32.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.486 . . . . 3.1299999999999999 110.31 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . 0.511 HG21 ' HD3' ' A' ' 852' ' ' ARG . 1.7 pp -144.65 174.14 3.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.066 0.46 . . . . 1.52 111.89 -179.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.824 ' HB2' ' HB3' ' A' ' 852' ' ' ARG . 5.4 mmtp -105.54 172.94 6.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.649 -0.705 . . . . 1.4299999999999999 110.32 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.498 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 9.0 p90 -158.03 163.01 38.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.932 0.396 . . . . 1.24 111.421 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . 0.412 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 0.4 OUTLIER -82.32 107.59 15.11 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.902 -0.59 . . . . 2.0899999999999999 110.713 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.854 ' HB3' HG23 ' A' ' 826' ' ' VAL . 0.2 OUTLIER -79.02 -178.76 6.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.479 -0.782 . . . . 1.8 110.795 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . 0.433 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 7.5 pt-20 -82.86 38.61 0.59 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.294 -0.412 . . . . 1.6200000000000001 111.284 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -140.16 9.1 2.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.34 -0.391 . . . . 1.6499999999999999 110.848 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . 0.409 ' HA2' ' NE2' ' A' ' 819' ' ' GLN . . . 65.1 49.08 63.96 Favored Glycine 0 C--N 1.331 0.258 0 C-N-CA 120.682 -0.771 . . . . 0.88 112.287 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -169.29 134.3 1.5 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.982 0.42 . . . . 1.8600000000000001 110.617 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.498 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 94.5 m-85 -63.69 136.03 57.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.881 -0.599 . . . . 0.80000000000000004 110.871 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.854 HG23 ' HB3' ' A' ' 820' ' ' ASP . 3.0 m -126.46 179.15 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 1.73 110.595 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.93 114.53 36.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.954 0.407 . . . . 1.21 111.537 -179.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 4.8 tp -83.17 122.44 28.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.809 -0.632 . . . . 1.52 110.86 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.29 -75.36 0.48 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.783 -0.722 . . . . 1.0900000000000001 112.619 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -161.75 -141.97 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 110.499 -0.186 . . . . 1.8 110.499 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -59.41 -16.39 22.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.729 0.3 . . . . 2.2000000000000002 110.84 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -75.05 -66.32 0.77 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.235 -0.439 . . . . 2.21 110.613 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.494 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 13.4 m-20 -61.59 -15.15 36.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.285 -0.416 . . . . 0.72999999999999998 110.263 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.417 ' O ' ' HG3' ' A' ' 838' ' ' LYS . 2.8 t-105 -82.37 -39.27 22.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.29999999999999999 109.59 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . 0.673 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -69.61 -37.74 76.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.86 -0.609 . . . . 2.8500000000000001 109.751 178.776 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . 0.439 HG23 ' ND2' ' A' ' 835' ' ' ASN . 24.3 t -69.88 -54.65 18.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.557 -0.747 . . . . 1.4399999999999999 109.675 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -55.97 -24.72 40.14 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.855 -0.612 . . . . 1.04 110.324 179.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.673 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 27.8 mtmt -71.88 -45.49 61.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.835 -0.62 . . . . 1.3600000000000001 110.317 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -65.22 -17.64 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.835 -0.621 . . . . 1.95 110.349 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 840' ' ' MET . . . . . 0.433 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 6.2 ttp -83.46 -33.85 25.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.683 -0.69 . . . . 1.0900000000000001 110.403 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.61 HD22 ' HB3' ' A' ' 846' ' ' GLU . 20.5 mt -68.84 -45.79 70.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 1.1799999999999999 110.898 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.478 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -64.88 -28.14 69.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 1.1799999999999999 111.407 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.81 8.26 0.93 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.227 -0.442 . . . . 1.6799999999999999 110.74 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.478 ' H ' ' C ' ' A' ' 842' ' ' ALA . 11.2 m-80 -146.53 16.56 1.29 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.018 -0.537 . . . . 1.96 110.802 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 59.93 19.6 8.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.051 -0.522 . . . . 2.4700000000000002 111.128 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.61 ' HB3' HD22 ' A' ' 841' ' ' LEU . 3.2 mt-10 -83.5 170.85 13.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.422 -0.354 . . . . 2.2999999999999998 110.654 179.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.07 -30.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.425 -0.352 . . . . 2.46 111.273 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.444 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 4.1 m-85 -82.4 143.09 31.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.918 0.39 . . . . 1.52 111.041 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.552 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.5 OUTLIER -122.29 121.33 36.5 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.04 -0.527 . . . . 1.3799999999999999 110.744 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.44 ' OD1' HG22 ' A' ' 782' ' ' THR . 4.6 m-20 -75.45 161.65 29.03 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.993 -0.549 . . . . 1.5600000000000001 111.327 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.677 HD13 HD11 ' A' ' 798' ' ' ILE . 6.0 mt -133.44 165.01 33.43 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.104 0 CA-C-N 116.184 -0.462 . . . . 1.73 111.025 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.824 ' HB3' ' HB2' ' A' ' 817' ' ' LYS . 1.4 ptm180 -44.84 -86.52 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.458 -0.337 . . . . 5.6399999999999997 111.684 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . 0.424 HD13 ' HB2' ' A' ' 781' ' ' PHE . 0.4 OUTLIER 53.85 26.46 6.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.415 -0.357 . . . . 2.8900000000000001 111.034 -179.69 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 24.2 p90 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.129 -0.939 . . . . 3.3900000000000001 110.86 179.952 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.532 -0.227 . . . . 9.4199999999999999 112.532 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -122.53 -22.3 5.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.776 0.322 . . . . 8.4800000000000004 111.054 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 5.4 mtt -95.95 -39.76 9.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 8.6400000000000006 110.991 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 89.57 116.22 1.58 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.833 -0.699 . . . . 4.2800000000000002 112.291 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 43.6 p -92.53 132.83 36.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.871 0.367 . . . . 3.0 111.139 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.455 HG21 ' OD1' ' A' ' 850' ' ' ASN . 0.2 OUTLIER -109.43 -178.64 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.155 -0.475 . . . . 1.75 110.855 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.586 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.37 97.45 1.23 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.985 0.422 . . . . 1.3600000000000001 109.911 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -96.86 94.14 7.07 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.297 0.57 . . . . 1.1899999999999999 110.765 -179.438 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . 0.422 ' O ' HG12 ' A' ' 785' ' ' VAL . 0.2 OUTLIER -92.16 114.65 27.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.42 -0.809 . . . . 2.1499999999999999 111.036 -179.489 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.8 tt -62.12 103.99 0.43 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.072 -0.513 . . . . 1.53 110.535 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.422 HG12 ' O ' ' A' ' 783' ' ' LEU . 26.3 m -98.4 -172.0 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.979 -0.555 . . . . 1.79 111.413 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.43 176.27 8.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.138 -0.483 . . . . 1.3999999999999999 110.882 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.98 35.46 0.79 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.097 0.475 . . . . 3.3399999999999999 110.806 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.0 p -150.77 -28.38 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.674 -0.694 . . . . 1.0900000000000001 110.896 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 23.3 m0 -49.06 124.24 8.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.826 -0.624 . . . . 0.34000000000000002 111.736 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.66 166.66 12.68 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.142 -0.688 . . . . 1.8899999999999999 109.142 178.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.434 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 77.2 t80 -52.83 -24.1 8.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.944 0.402 . . . . 0.73999999999999999 110.172 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.624 ' O ' ' HG3' ' A' ' 796' ' ' MET . 2.1 t70 -72.25 -62.49 1.42 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.868 -0.605 . . . . 2.0499999999999998 109.697 178.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . 0.684 ' HA ' ' HE3' ' A' ' 796' ' ' MET . 1.6 t0 -53.63 -27.02 24.71 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 116.158 -0.474 . . . . 1.0700000000000001 110.356 179.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.455 ' HA ' HD13 ' A' ' 794' ' ' LEU . 26.9 tp -70.19 -54.34 13.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.858 -0.61 . . . . 1.55 110.478 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.669 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 23.5 mm -59.23 -34.1 52.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.654 -0.703 . . . . 1.0800000000000001 111.868 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.684 ' HE3' ' HA ' ' A' ' 793' ' ' ASP . 21.8 mtm -71.17 -43.4 67.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.636 0.255 . . . . 2.21 111.067 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.95 79.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.272 0.558 . . . . 1.0900000000000001 109.975 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.401 ' O ' HG23 ' A' ' 802' ' ' ILE . 48.1 mt -62.94 -47.8 91.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.446 -0.797 . . . . 1.1799999999999999 110.281 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.717 ' HA ' HG12 ' A' ' 802' ' ' ILE . 0.8 OUTLIER -56.13 -29.58 60.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.846 -0.616 . . . . 1.2 111.133 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.84 -29.49 58.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 1.52 110.848 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . 0.51 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -94.41 -3.93 49.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 2.73 111.467 -179.77 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.717 HG12 ' HA ' ' A' ' 799' ' ' ASN . 7.0 pt -113.76 -22.15 5.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.761 0.315 . . . . 1.4099999999999999 111.244 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.29 92.03 0.54 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.258 -0.428 . . . . 2.0099999999999998 111.006 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -103.14 -13.25 16.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 3.3900000000000001 110.8 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -114.61 159.81 20.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 4.5899999999999999 110.968 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -110.29 164.27 12.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.439 . . . . 8.4399999999999995 110.86 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 55.26 69.9 0.69 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.088 -0.505 . . . . 6.8600000000000003 110.888 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -119.42 -66.72 1.04 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.115 -0.493 . . . . 7.4100000000000001 110.836 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -167.25 -41.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.455 . . . . 7.1100000000000003 110.921 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 4.6 pt -130.65 177.79 6.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.167 -0.469 . . . . 5.1699999999999999 111.164 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.45 154.77 37.01 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.047 -0.524 . . . . 2.2000000000000002 110.88 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -51.1 156.31 5.25 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.612 2.208 . . . . 1.3799999999999999 112.484 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 4.4 mm -107.61 148.7 11.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 2.4399999999999999 111.092 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 82.1 p -115.94 -47.2 2.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.25 -0.432 . . . . 1.73 111.374 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.94 139.18 30.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.266 -0.425 . . . . 3.1299999999999999 111.093 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -150.63 168.77 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.126 -0.488 . . . . 1.52 111.169 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.474 ' HG3' ' HE1' ' A' ' 854' ' ' TYR . 14.6 mmtt -115.45 134.63 54.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 1.4299999999999999 110.646 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.452 ' HB2' HD13 ' A' ' 849' ' ' LEU . 5.4 p90 -113.33 168.48 9.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.893 0.378 . . . . 1.24 111.26 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -93.68 105.99 17.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.975 -0.557 . . . . 2.0899999999999999 110.761 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.819 ' HB2' HG22 ' A' ' 826' ' ' VAL . 4.6 t0 -79.07 169.65 17.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.83 -0.623 . . . . 1.8 110.373 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.9 52.65 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.189 0.518 . . . . 1.6200000000000001 111.105 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 -141.05 1.5 1.65 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.679 -0.691 . . . . 1.6499999999999999 110.463 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 74.6 44.44 26.39 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.882 -0.675 . . . . 0.88 111.982 -179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -174.08 142.44 0.84 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 121.164 0.507 . . . . 1.8600000000000001 110.57 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.426 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 70.6 m-85 -72.25 147.26 46.64 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.625 -0.716 . . . . 0.80000000000000004 110.462 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.819 HG22 ' HB2' ' A' ' 820' ' ' ASP . 2.4 m -137.48 177.92 5.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.305 -0.407 . . . . 1.73 110.726 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.93 118.65 45.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.019 0.438 . . . . 1.21 111.35 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.54 HD13 ' HB3' ' A' ' 833' ' ' ASP . 3.5 tp -79.75 113.67 18.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.767 -0.651 . . . . 1.52 110.745 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -58.01 -71.75 0.7 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.995 -0.621 . . . . 1.0900000000000001 112.751 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 57.4 p -171.07 -136.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.502 0.191 . . . . 1.8 110.732 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.456 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 0.7 OUTLIER -57.85 -20.59 37.44 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.771 0.32 . . . . 2.2000000000000002 110.967 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . 0.475 ' O ' HG21 ' A' ' 836' ' ' VAL . 0.5 OUTLIER -72.62 -68.29 0.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.428 . . . . 2.21 110.947 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.54 ' HB3' HD13 ' A' ' 828' ' ' LEU . 0.6 OUTLIER -60.9 -13.35 15.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.72999999999999998 110.793 179.776 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.474 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.5 t-105 -86.26 -40.38 15.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.9 0.381 . . . . 0.29999999999999999 110.111 179.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . 0.711 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -68.91 -37.09 78.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.95 -0.568 . . . . 2.8500000000000001 109.885 179.064 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . 0.475 HG21 ' O ' ' A' ' 832' ' ' GLU . 39.9 t -72.25 -54.47 16.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.462 -0.79 . . . . 1.4399999999999999 110.149 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -58.01 -25.48 61.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.0 -0.545 . . . . 1.04 110.601 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.711 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 23.8 mtmt -69.73 -42.67 73.66 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.169 -0.469 . . . . 1.3600000000000001 110.191 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . 0.408 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 5.0 mt-10 -68.11 -25.93 65.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.061 -0.518 . . . . 1.95 110.161 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 12.4 ttp -74.97 -35.72 62.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.746 -0.661 . . . . 1.0900000000000001 110.497 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.714 HD21 ' HB3' ' A' ' 846' ' ' GLU . 15.4 mt -67.69 -49.21 63.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.088 -0.506 . . . . 1.1799999999999999 110.917 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.431 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -80.46 -0.34 36.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 1.1799999999999999 111.544 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 0.5 OUTLIER -66.43 -0.86 2.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.998 0.428 . . . . 1.6799999999999999 110.377 179.466 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 842' ' ' ALA . 41.8 m-80 -149.74 -71.2 0.19 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.847 -0.615 . . . . 1.96 110.63 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -177.82 26.33 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.959 -0.564 . . . . 2.4700000000000002 111.162 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.714 ' HB3' HD21 ' A' ' 841' ' ' LEU . 2.6 mt-10 -100.62 140.93 34.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.824 0.345 . . . . 2.2999999999999998 110.876 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.3 2.84 2.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 2.46 110.931 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -111.02 126.03 54.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.358 -0.383 . . . . 1.52 110.947 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.503 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.0 OUTLIER -97.37 133.32 42.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.083 -0.508 . . . . 1.3799999999999999 110.697 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.46 ' OD1' HG23 ' A' ' 782' ' ' THR . 6.5 m-20 -85.59 153.93 22.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 1.5600000000000001 111.197 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.586 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.4 mm -136.65 162.18 35.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.202 -0.454 . . . . 1.73 111.096 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.558 ' HB3' ' HD1' ' A' ' 854' ' ' TYR . 0.0 OUTLIER -111.46 -44.58 3.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.49 -0.323 . . . . 5.6399999999999997 110.759 179.732 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 2.1 mt 57.99 24.55 11.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.025 -0.534 . . . . 2.8900000000000001 111.074 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . 0.558 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 2.0 p90 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.224 -0.894 . . . . 3.3900000000000001 110.983 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 N-CA-C 112.526 -0.229 . . . . 9.4199999999999999 112.526 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -89.39 86.82 6.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.76 0.314 . . . . 8.4800000000000004 111.275 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 55.3 70.63 0.61 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.082 -0.508 . . . . 8.6400000000000006 111.209 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -87.29 158.57 30.21 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.853 -0.689 . . . . 4.2800000000000002 112.304 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 779' ' ' SER . . . . . 0.426 ' O ' HD21 ' A' ' 853' ' ' LEU . 0.3 OUTLIER -152.66 -173.66 4.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 3.0 111.013 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -127.1 -160.09 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.022 -0.535 . . . . 1.75 110.719 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.584 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -133.59 78.44 1.77 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.112 0.482 . . . . 1.3600000000000001 110.113 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.1 OUTLIER -98.46 115.7 29.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 1.1899999999999999 111.378 -179.401 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . 0.499 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -116.9 -167.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.709 -0.678 . . . . 2.1499999999999999 110.672 179.832 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -116.34 110.92 19.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.028 -0.533 . . . . 1.53 110.372 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.433 HG21 ' HH2' ' A' ' 834' ' ' TRP . 28.8 m -107.45 158.57 7.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 1.79 111.539 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.65 ' HG2' HG12 ' A' ' 788' ' ' VAL . 1.1 tt0 -110.18 171.06 7.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.983 -0.553 . . . . 1.3999999999999999 110.725 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -79.19 -9.36 59.54 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.039 0.447 . . . . 3.3399999999999999 110.783 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . 0.65 HG12 ' HG2' ' A' ' 786' ' ' GLU . 2.7 p -96.06 -24.26 4.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.785 -0.643 . . . . 1.0900000000000001 110.848 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -56.73 126.17 25.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.34000000000000002 111.931 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.85 167.94 10.79 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.009 -0.737 . . . . 1.8899999999999999 109.009 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.419 ' O ' HG12 ' A' ' 795' ' ' ILE . 80.6 t80 -54.67 -24.3 21.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.885 0.374 . . . . 0.73999999999999999 110.069 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.525 ' O ' ' HG3' ' A' ' 796' ' ' MET . 24.1 m-20 -73.58 -57.6 3.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.979 -0.555 . . . . 2.0499999999999998 109.758 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.31 -30.5 64.8 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.166 -0.47 . . . . 1.0700000000000001 110.124 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 30.2 tp -65.46 -54.72 24.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.712 -0.676 . . . . 1.55 110.281 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.644 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 30.3 mm -57.25 -27.98 29.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.484 -0.78 . . . . 1.0800000000000001 111.535 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.525 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.5 mtt -68.18 -51.01 50.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.716 0.294 . . . . 2.21 110.548 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.04 -53.06 58.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.057 0.456 . . . . 1.0900000000000001 109.911 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.782 HD12 HD13 ' A' ' 851' ' ' ILE . 74.2 mt -57.49 -53.02 49.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.643 -0.708 . . . . 1.1799999999999999 110.428 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.644 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.7 OUTLIER -54.96 -24.64 24.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.563 -0.744 . . . . 1.2 111.283 -179.852 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 800' ' ' SER . . . . . 0.5 ' HA ' ' HB2' ' A' ' 804' ' ' ASN . 42.1 t -78.79 -27.56 44.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.349 -0.387 . . . . 1.52 110.537 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.41 4.6 36.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.985 -0.552 . . . . 2.73 111.358 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.72 HD11 HG12 ' A' ' 813' ' ' ILE . 1.0 OUTLIER -127.22 -23.63 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 111.933 0.346 . . . . 1.4099999999999999 111.933 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.415 ' N ' HG13 ' A' ' 802' ' ' ILE . 34.9 t -122.86 -28.73 4.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.729 0.299 . . . . 2.0099999999999998 111.078 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . 0.5 ' HB2' ' HA ' ' A' ' 800' ' ' SER . 0.9 OUTLIER -94.5 137.59 33.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.306 -0.406 . . . . 3.3900000000000001 110.952 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 55.94 71.98 0.52 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.121 -0.491 . . . . 4.5899999999999999 111.277 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -130.69 -80.9 0.54 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.395 -0.366 . . . . 8.4399999999999995 110.901 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -146.4 -71.03 0.24 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.165 -0.471 . . . . 6.8600000000000003 110.858 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 40.2 p-10 -173.34 0.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.213 -0.449 . . . . 7.4100000000000001 111.05 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -101.32 165.94 11.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.286 -0.415 . . . . 7.1100000000000003 111.022 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 2.0 pt -133.55 122.5 43.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.099 -0.501 . . . . 5.1699999999999999 111.013 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 66.8 m -149.6 67.62 8.81 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.241 -0.436 . . . . 2.2000000000000002 111.168 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.87 168.49 7.08 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.576 2.184 . . . . 1.3799999999999999 112.105 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.72 HG12 HD11 ' A' ' 802' ' ' ILE . 8.7 pt -140.93 -176.25 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.959 0.409 . . . . 2.4399999999999999 111.294 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 814' ' ' THR . . . . . 0.508 ' HA ' HD11 ' A' ' 795' ' ' ILE . 1.6 t -158.57 -40.42 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.97 -0.559 . . . . 1.73 110.981 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.79 126.92 52.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.081 -0.509 . . . . 3.1299999999999999 110.821 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -155.27 -176.17 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 1.52 111.365 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.78 ' H ' ' HB2' ' A' ' 852' ' ' ARG . 17.5 mmtt -108.64 169.67 8.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 1.4299999999999999 110.595 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.421 ' CE1' HG21 ' A' ' 826' ' ' VAL . 11.0 p90 -157.29 157.25 33.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.988 0.423 . . . . 1.24 111.191 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . 0.502 ' HA ' ' O ' ' A' ' 824' ' ' ASP . 55.3 tt0 -76.33 102.15 5.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.897 -0.592 . . . . 2.0899999999999999 111.039 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -79.24 -176.01 4.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.587 -0.733 . . . . 1.8 110.627 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -81.79 15.13 2.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.362 -0.381 . . . . 1.6200000000000001 111.185 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.34 6.11 44.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.432 . . . . 1.6499999999999999 111.07 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 75.2 16.35 80.65 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.736 . . . . 0.88 112.482 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . 0.502 ' O ' ' HA ' ' A' ' 819' ' ' GLN . 2.8 t0 -143.49 -147.35 0.21 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.754 0.311 . . . . 1.8600000000000001 110.358 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.46 ' HB2' ' OH ' ' A' ' 854' ' ' TYR . 49.3 m-85 -129.02 150.89 50.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.295 -0.411 . . . . 0.80000000000000004 110.895 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.421 HG21 ' CE1' ' A' ' 818' ' ' TYR . 8.4 m -139.14 -178.58 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 1.73 110.558 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -98.64 113.41 33.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.969 0.414 . . . . 1.21 111.682 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -80.36 120.27 24.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.909 -0.587 . . . . 1.52 110.63 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -68.48 -72.5 0.81 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.847 -0.692 . . . . 1.0900000000000001 112.621 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.79 -136.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.492 0.187 . . . . 1.8 110.51 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -59.61 -16.26 24.52 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.702 0.287 . . . . 2.2000000000000002 110.822 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . 0.462 ' O ' HG23 ' A' ' 836' ' ' VAL . 32.0 mt-10 -74.89 -70.4 0.41 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.284 -0.417 . . . . 2.21 110.827 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.581 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 21.8 m-20 -61.77 -11.76 13.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.72999999999999998 110.841 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.477 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 2.0 t-105 -84.01 -40.7 18.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.891 0.377 . . . . 0.29999999999999999 110.17 179.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . 0.737 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -69.07 -35.22 76.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 2.8500000000000001 110.024 179.112 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 832' ' ' GLU . 13.2 t -74.71 -53.56 16.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 1.4399999999999999 110.132 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.581 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -56.57 -27.16 57.22 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.124 -0.489 . . . . 1.04 110.488 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.737 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 21.4 mtmt -68.55 -47.89 65.71 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.988 -0.551 . . . . 1.3600000000000001 110.336 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.97 -25.63 67.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.485 . . . . 1.95 110.27 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.7 ttp -73.05 -35.21 66.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.779 -0.646 . . . . 1.0900000000000001 110.269 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.646 HD23 ' HB3' ' A' ' 846' ' ' GLU . 6.0 mt -67.67 -50.76 56.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.825 -0.625 . . . . 1.1799999999999999 110.659 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.435 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.18 -2.28 36.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.11 -0.495 . . . . 1.1799999999999999 111.263 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.85 -4.92 2.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.001 0.429 . . . . 1.6799999999999999 110.211 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.435 ' H ' ' C ' ' A' ' 842' ' ' ALA . 3.1 m120 -147.67 -71.22 0.22 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.633 -0.712 . . . . 1.96 110.538 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 177.36 30.18 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.906 -0.588 . . . . 2.4700000000000002 110.725 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.646 ' HB3' HD23 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -96.0 142.16 28.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 2.2999999999999998 111.292 -179.602 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -136.49 -4.77 2.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.014 -0.539 . . . . 2.46 110.658 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.499 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 58.3 m-85 -91.33 136.26 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.957 -0.565 . . . . 1.52 110.905 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.503 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.3 OUTLIER -128.91 124.0 34.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 1.3799999999999999 111.122 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.4 ' C ' HG12 ' A' ' 851' ' ' ILE . 3.4 m-20 -85.46 169.14 13.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.075 -0.511 . . . . 1.5600000000000001 110.851 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.782 HD13 HD12 ' A' ' 798' ' ' ILE . 1.0 OUTLIER -134.48 170.63 19.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.434 -0.348 . . . . 1.73 111.51 -179.699 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.78 ' HB2' ' H ' ' A' ' 817' ' ' LYS . 13.2 ttt180 -44.1 -82.55 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.134 -0.485 . . . . 5.6399999999999997 111.534 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . 0.426 HD21 ' O ' ' A' ' 779' ' ' SER . 0.4 OUTLIER 44.36 44.96 7.19 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.802 0.334 . . . . 2.8900000000000001 111.425 179.803 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . 0.658 ' HD2' ' HG3' ' A' ' 852' ' ' ARG . 13.2 m-85 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.293 -0.86 . . . . 3.3900000000000001 110.768 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.477 -0.249 . . . . 9.4199999999999999 112.477 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -153.08 136.19 15.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.758 0.313 . . . . 8.4800000000000004 111.036 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 2.6 ttm -138.43 139.71 39.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 8.6400000000000006 110.98 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 110.58 143.98 9.84 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.823 -0.703 . . . . 4.2800000000000002 112.531 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 1.5 t -117.08 -175.67 2.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.76 0.314 . . . . 3.0 110.958 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.09 -169.37 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.185 -0.462 . . . . 1.75 111.038 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.717 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.46 95.44 1.12 Allowed 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.999 0.428 . . . . 1.3600000000000001 110.077 179.744 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -97.54 89.33 4.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.997 -0.547 . . . . 1.1899999999999999 111.0 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.27 137.51 32.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 2.1499999999999999 110.682 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.61 107.49 0.96 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.114 0.483 . . . . 1.53 110.45 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.418 ' HB ' ' O ' ' A' ' 847' ' ' LYS . 17.6 t -96.29 136.04 28.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.497 -0.774 . . . . 1.79 110.712 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -97.3 165.32 12.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 1.3999999999999999 110.969 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.01 51.1 2.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.069 -0.514 . . . . 3.3399999999999999 110.651 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 1.5 p -164.53 -28.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.882 -0.599 . . . . 1.0900000000000001 110.605 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 26.4 m0 -47.75 130.83 14.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.608 -0.724 . . . . 0.34000000000000002 112.035 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.82 168.28 10.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.831 -0.803 . . . . 1.8899999999999999 108.831 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -53.34 -24.14 11.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.005 0.431 . . . . 0.73999999999999999 110.329 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.64 ' O ' ' HG3' ' A' ' 796' ' ' MET . 17.5 m-20 -76.85 -60.61 2.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.846 -0.615 . . . . 2.0499999999999998 109.66 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -55.14 -21.83 14.64 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-O 121.093 0.473 . . . . 1.0700000000000001 109.804 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.46 ' HA ' HD12 ' A' ' 794' ' ' LEU . 40.2 tp -73.81 -60.24 2.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.535 -0.757 . . . . 1.55 110.365 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.659 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 19.0 mm -57.1 -36.65 52.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.394 -0.821 . . . . 1.0800000000000001 111.988 -179.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.64 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.2 mtt -69.59 -39.44 77.3 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.68 0.276 . . . . 2.21 110.837 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -65.34 -50.77 64.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.211 0.529 . . . . 1.0900000000000001 110.05 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.447 HD13 HD11 ' A' ' 794' ' ' LEU . 31.0 mt -61.4 -48.26 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 115.495 -0.775 . . . . 1.1799999999999999 110.349 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.659 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.9 OUTLIER -56.35 -34.79 66.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.765 -0.652 . . . . 1.2 110.952 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.96 -24.07 60.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.266 -0.425 . . . . 1.52 110.715 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . 0.575 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -99.29 -2.21 37.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.075 -0.511 . . . . 2.73 111.419 -179.887 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.658 HD11 HG12 ' A' ' 813' ' ' ILE . 1.3 pp -116.13 -22.91 4.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.718 0.294 . . . . 1.4099999999999999 111.533 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 55.7 p -147.61 86.39 1.6 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.344 -0.389 . . . . 2.0099999999999998 110.9 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -153.7 121.83 6.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.107 -0.497 . . . . 3.3900000000000001 110.855 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 55.2 79.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 4.5899999999999999 111.119 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 62.25 -83.06 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.954 -0.566 . . . . 8.4399999999999995 111.383 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 63.85 179.41 0.16 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.285 -0.416 . . . . 6.8600000000000003 110.852 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.73 -38.92 16.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.088 -0.505 . . . . 7.4100000000000001 110.949 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -72.28 158.52 35.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 7.1100000000000003 110.985 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -124.17 132.09 71.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 5.1699999999999999 111.101 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 14.7 t 64.71 143.5 0.08 OUTLIER Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 116.061 -0.518 . . . . 2.2000000000000002 111.327 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -74.23 -173.13 1.34 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.437 2.092 . . . . 1.3799999999999999 112.395 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.658 HG12 HD11 ' A' ' 802' ' ' ILE . 5.5 pt -146.55 171.32 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.276 -0.42 . . . . 2.4399999999999999 111.07 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 19.4 p -128.82 -67.3 0.79 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.193 -0.458 . . . . 1.73 111.129 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.3 mptt -83.51 137.84 33.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 3.1299999999999999 110.736 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . 0.508 HG23 ' HD3' ' A' ' 852' ' ' ARG . 0.9 OUTLIER -152.03 -178.18 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.296 -0.411 . . . . 1.52 111.603 -179.749 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.935 ' HB2' ' HB3' ' A' ' 852' ' ' ARG . 6.8 mmtt -120.24 155.02 34.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.86 -0.609 . . . . 1.4299999999999999 110.691 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.534 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 5.2 p90 -136.47 174.29 10.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.468 -0.333 . . . . 1.24 111.133 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -96.09 106.58 18.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.213 -0.449 . . . . 2.0899999999999999 111.043 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.85 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.7 t70 -79.31 173.3 12.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.8 -0.637 . . . . 1.8 110.938 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . 0.408 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 3.0 pt-20 -79.21 33.55 0.23 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.224 -0.444 . . . . 1.6200000000000001 111.19 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . 0.414 ' H ' ' C ' ' A' ' 820' ' ' ASP . 3.7 m-20 -128.85 8.88 5.77 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.225 -0.443 . . . . 1.6499999999999999 110.554 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 64.22 51.89 48.93 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.86 -0.686 . . . . 0.88 112.414 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -176.03 141.13 0.44 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.146 0.498 . . . . 1.8600000000000001 110.598 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.534 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 58.9 m-85 -66.73 145.25 55.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.636 -0.711 . . . . 0.80000000000000004 110.747 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.85 HG22 ' HB2' ' A' ' 820' ' ' ASP . 0.9 OUTLIER -138.51 178.1 4.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 1.73 110.824 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . 0.494 HG12 ' HE2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -99.1 116.46 42.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.0 0.428 . . . . 1.21 111.326 -179.736 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 4.3 tp -82.33 108.17 15.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.8 -0.636 . . . . 1.52 110.876 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -58.09 -69.38 1.3 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.863 -0.684 . . . . 1.0900000000000001 112.691 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 830' ' ' SER . . . . . 0.426 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 3.0 p -170.07 -143.42 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 110.497 -0.186 . . . . 1.8 110.497 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.426 ' H ' ' HB2' ' A' ' 830' ' ' SER . 20.2 t70 -56.48 -19.17 14.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.716 0.293 . . . . 2.2000000000000002 110.831 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -70.47 -68.49 0.42 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.356 -0.384 . . . . 2.21 110.552 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.33 -12.22 28.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.399 -0.364 . . . . 0.72999999999999998 110.357 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.538 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.0 OUTLIER -82.68 -44.41 15.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.061 -0.518 . . . . 0.29999999999999999 110.363 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -35.25 80.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.049 -0.523 . . . . 2.8500000000000001 109.947 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.11 -54.6 14.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.546 -0.752 . . . . 1.4399999999999999 110.079 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.82 -26.52 46.84 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.095 -0.502 . . . . 1.04 110.506 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -67.42 -50.13 60.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.075 -0.511 . . . . 1.3600000000000001 110.277 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -58.64 -24.5 61.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.938 -0.574 . . . . 1.95 110.136 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 840' ' ' MET . . . . . 0.408 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 6.7 ttp -74.86 -36.4 62.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.691 -0.686 . . . . 1.0900000000000001 110.444 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.632 HD22 ' HB3' ' A' ' 846' ' ' GLU . 17.0 mt -60.7 -43.23 98.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.082 -0.508 . . . . 1.1799999999999999 110.433 179.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.482 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -74.3 -27.39 60.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.545 . . . . 1.1799999999999999 111.181 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.35 7.63 0.99 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.048 -0.524 . . . . 1.6799999999999999 110.708 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.482 ' H ' ' C ' ' A' ' 842' ' ' ALA . 24.1 m-80 -148.04 17.2 1.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.062 -0.517 . . . . 1.96 110.714 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.7 t30 60.22 12.59 3.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.17 -0.468 . . . . 2.4700000000000002 110.872 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.632 ' HB3' HD22 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -77.16 171.01 15.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.973 -0.558 . . . . 2.2999999999999998 111.142 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . 0.418 ' O ' ' HB ' ' A' ' 785' ' ' VAL . 0.0 OUTLIER -152.21 -37.12 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.628 -0.714 . . . . 2.46 110.244 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -83.49 147.14 27.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.019 -0.537 . . . . 1.52 110.783 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.6 OUTLIER -123.38 132.63 54.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.219 -0.446 . . . . 1.3799999999999999 111.026 179.74 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -85.65 154.15 21.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 1.5600000000000001 110.936 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.717 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -121.43 169.05 13.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.21 -0.45 . . . . 1.73 111.047 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.935 ' HB3' ' HB2' ' A' ' 817' ' ' LYS . 1.6 ptm180 -53.74 -95.16 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.309 -0.405 . . . . 5.6399999999999997 111.475 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 7.6 mp 54.45 22.75 4.03 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.407 -0.36 . . . . 2.8900000000000001 111.213 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 7.1 p90 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.222 -0.894 . . . . 3.3900000000000001 110.995 179.946 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.183 0 N-CA-C 112.442 -0.263 . . . . 9.4199999999999999 112.442 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -95.02 -67.14 0.87 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.847 0.356 . . . . 8.4800000000000004 111.109 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 2.6 mtt -93.7 108.53 20.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 8.6400000000000006 110.754 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 169.97 92.88 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.681 -0.771 . . . . 4.2800000000000002 112.745 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 2.3 p -97.73 9.59 42.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.888 0.375 . . . . 3.0 110.793 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.43 -155.02 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.071 -0.513 . . . . 1.75 111.097 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.497 ' HB3' ' CD1' ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.79 99.58 2.01 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 109.097 -0.705 . . . . 1.3600000000000001 109.097 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.602 HG21 ' HB3' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -96.46 94.87 7.65 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.723 -0.671 . . . . 1.1899999999999999 110.945 -178.851 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 783' ' ' LEU . 0.2 OUTLIER -100.23 104.84 16.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.521 -0.763 . . . . 2.1499999999999999 110.872 -179.755 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.44 114.08 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.105 -0.498 . . . . 1.53 110.567 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.427 HG13 HD11 ' A' ' 794' ' ' LEU . 30.7 m -103.41 179.55 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.451 -0.795 . . . . 1.79 111.434 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.534 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 5.1 tp10 -122.97 176.7 5.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.968 -0.56 . . . . 1.3999999999999999 110.842 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . 0.534 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 2.5 mttt -90.0 54.96 2.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 3.3399999999999999 110.751 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.4 p -171.44 -27.97 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.107 -0.497 . . . . 1.0900000000000001 111.058 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -50.33 126.13 14.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.816 -0.629 . . . . 0.34000000000000002 112.086 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.89 167.93 11.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.708 -0.849 . . . . 1.8899999999999999 108.708 178.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.446 ' O ' HG12 ' A' ' 795' ' ' ILE . 87.4 t80 -54.51 -27.15 36.11 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.659 -0.416 . . . . 0.73999999999999999 110.179 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.532 ' O ' ' HG3' ' A' ' 796' ' ' MET . 30.4 m-20 -70.71 -56.49 6.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.008 -0.542 . . . . 2.0499999999999998 109.622 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.96 -31.09 66.53 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.138 -0.483 . . . . 1.0700000000000001 110.279 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.427 HD11 HG13 ' A' ' 785' ' ' VAL . 31.7 tp -65.86 -54.48 26.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.826 -0.625 . . . . 1.55 110.468 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.648 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 26.8 mm -54.11 -29.89 19.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.499 -0.773 . . . . 1.0800000000000001 111.744 -179.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.8 mtp -69.03 -51.59 37.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.558 0.218 . . . . 2.21 110.623 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.27 -50.85 66.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.072 0.463 . . . . 1.0900000000000001 110.157 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.531 HD12 HD11 ' A' ' 851' ' ' ILE . 63.6 mt -60.3 -53.37 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.63 -0.714 . . . . 1.1799999999999999 110.556 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.726 HD22 ' HB3' ' A' ' 812' ' ' PRO . 0.2 OUTLIER -54.33 -27.24 34.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.482 -0.781 . . . . 1.2 111.458 -179.749 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.11 -29.18 48.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.438 -0.346 . . . . 1.52 111.099 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . 0.453 ' HE3' ' HA ' ' A' ' 801' ' ' LYS . 0.2 OUTLIER -93.14 -9.29 39.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.397 -0.365 . . . . 2.73 111.488 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.719 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.0 OUTLIER -100.75 -31.0 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.825 0.345 . . . . 1.4099999999999999 111.278 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.529 ' N ' HG13 ' A' ' 802' ' ' ILE . 69.0 p -135.42 65.71 1.54 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.272 -0.422 . . . . 2.0099999999999998 110.817 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -65.77 173.94 2.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.476 . . . . 3.3900000000000001 111.062 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 74.7 p -87.16 20.51 2.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 4.5899999999999999 111.019 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -76.04 -5.85 48.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.168 -0.469 . . . . 8.4399999999999995 110.854 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 17.9 t30 57.43 57.7 4.24 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.059 -0.519 . . . . 6.8600000000000003 110.836 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -144.73 4.4 1.14 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.092 -0.503 . . . . 7.4100000000000001 110.873 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -154.87 131.65 10.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.146 -0.479 . . . . 7.1100000000000003 110.858 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 29.7 pt -121.63 -179.41 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.426 . . . . 5.1699999999999999 111.183 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 56.13 81.22 0.26 Allowed Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 2.2000000000000002 111.064 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . 0.726 ' HB3' HD22 ' A' ' 799' ' ' ASN . 38.9 Cg_exo -57.42 169.03 2.48 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.616 2.211 . . . . 1.3799999999999999 112.392 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.658 HG12 HD12 ' A' ' 802' ' ' ILE . 5.5 mm -119.6 161.78 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.038 -0.528 . . . . 2.4399999999999999 110.822 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -131.26 -62.23 0.89 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.54 -0.3 . . . . 1.73 111.414 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.13 142.41 32.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.37 -0.377 . . . . 3.1299999999999999 110.869 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -155.59 167.93 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.066 -0.516 . . . . 1.52 111.267 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.51 ' HE3' ' HH ' ' A' ' 854' ' ' TYR . 19.2 mmtt -105.41 149.6 25.99 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.99 -0.55 . . . . 1.4299999999999999 110.572 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.571 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 6.2 p90 -131.13 169.3 16.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.764 0.316 . . . . 1.24 111.356 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -92.14 107.08 18.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.071 -0.513 . . . . 2.0899999999999999 110.884 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.803 ' HB2' HG23 ' A' ' 826' ' ' VAL . 13.4 t70 -79.0 173.91 12.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.737 -0.665 . . . . 1.8 110.964 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . 0.641 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 12.4 pt-20 -71.02 0.92 6.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.244 -0.434 . . . . 1.6200000000000001 111.439 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.61 13.79 32.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.399 -0.364 . . . . 1.6499999999999999 110.796 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 55.58 55.22 29.81 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.812 -0.708 . . . . 0.88 112.277 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -171.93 135.37 0.82 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.006 0.432 . . . . 1.8600000000000001 110.553 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.571 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 65.3 m-85 -63.67 131.43 47.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.879 -0.6 . . . . 0.80000000000000004 110.895 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.803 HG23 ' HB2' ' A' ' 820' ' ' ASP . 1.8 m -127.63 -179.07 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.234 -0.439 . . . . 1.73 110.789 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . 0.422 HG22 ' HZ1' ' A' ' 817' ' ' LYS . 2.5 t -98.75 116.94 42.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.054 0.454 . . . . 1.21 111.295 -179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.71 108.0 12.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 1.52 110.689 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -56.8 -67.13 2.38 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.829 -0.7 . . . . 1.0900000000000001 112.692 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 830' ' ' SER . . . . . 0.426 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -173.86 -137.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.421 -0.214 . . . . 1.8 110.421 -179.791 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.46 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 28.3 t70 -59.88 -16.19 27.26 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.745 0.307 . . . . 2.2000000000000002 110.751 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.41 -69.43 0.4 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 2.21 110.854 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.601 ' O ' ' HB2' ' A' ' 837' ' ' ALA . 1.6 m-20 -62.91 -12.46 25.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.72999999999999998 110.519 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.444 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 3.4 t-105 -84.68 -39.67 18.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.277 -0.42 . . . . 0.29999999999999999 110.189 179.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . 0.695 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.3 OUTLIER -70.28 -33.48 71.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 2.8500000000000001 109.836 179.011 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 66.6 t -74.84 -55.9 10.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.476 -0.784 . . . . 1.4399999999999999 110.203 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.601 ' HB2' ' O ' ' A' ' 833' ' ' ASP . . . -56.12 -27.27 53.32 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.211 -0.449 . . . . 1.04 110.413 179.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.695 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 25.5 mtmt -66.44 -51.38 57.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.005 -0.543 . . . . 1.3600000000000001 110.359 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.69 -28.22 68.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 1.95 110.178 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 840' ' ' MET . . . . . 0.641 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 11.9 ttp -70.74 -36.71 73.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.715 -0.675 . . . . 1.0900000000000001 110.216 179.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 49.4 mt -67.04 -42.76 84.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.865 -0.607 . . . . 1.1799999999999999 110.914 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.47 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -72.01 -24.9 61.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 1.1799999999999999 111.235 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.04 6.11 1.01 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.309 -0.405 . . . . 1.6799999999999999 110.756 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.47 ' H ' ' C ' ' A' ' 842' ' ' ALA . 65.1 m-80 -150.86 21.1 0.79 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.087 -0.506 . . . . 1.96 110.851 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.3 15.1 4.05 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.036 -0.529 . . . . 2.4700000000000002 111.167 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.08 170.58 16.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.919 0.39 . . . . 2.2999999999999998 110.924 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -157.68 -22.28 0.09 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.92 -0.582 . . . . 2.46 111.272 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.602 ' HB3' HG21 ' A' ' 782' ' ' THR . 32.4 m-85 -86.4 122.49 30.43 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.841 0.353 . . . . 1.52 111.174 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.491 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.3 OUTLIER -105.86 121.45 44.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.014 -0.539 . . . . 1.3799999999999999 110.488 179.688 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.427 ' C ' HG13 ' A' ' 851' ' ' ILE . 14.1 m120 -76.82 141.27 40.75 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.457 -0.338 . . . . 1.5600000000000001 111.394 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.531 HD11 HD12 ' A' ' 798' ' ' ILE . 0.8 OUTLIER -138.44 152.51 25.34 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 CA-C-N 116.194 -0.457 . . . . 1.73 111.421 179.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -113.46 176.67 4.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.439 -0.346 . . . . 5.6399999999999997 110.838 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -135.3 32.86 3.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.265 -0.425 . . . . 2.8900000000000001 110.953 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . 0.51 ' HH ' ' HE3' ' A' ' 817' ' ' LYS . 2.9 p90 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.253 -0.879 . . . . 3.3900000000000001 110.829 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.175 0 N-CA-C 112.524 -0.23 . . . . 9.4199999999999999 112.524 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 59.03 -177.73 0.08 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.941 0.4 . . . . 8.4800000000000004 111.279 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.03 -10.74 58.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.022 -0.536 . . . . 8.6400000000000006 110.905 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 115.11 -23.96 11.05 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.799 -0.715 . . . . 4.2800000000000002 112.315 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.59 -44.28 82.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.781 0.324 . . . . 3.0 110.738 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.568 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 1.5 mt -121.64 161.45 22.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 1.75 111.054 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.738 ' HB3' HD13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -142.61 86.04 1.93 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.704 -0.48 . . . . 1.3600000000000001 109.704 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.561 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 2.1 m -97.76 118.76 35.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.82 -0.627 . . . . 1.1899999999999999 111.33 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . 0.528 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -129.65 -168.3 1.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.731 -0.668 . . . . 2.1499999999999999 111.031 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 784' ' ' LEU . 0.0 OUTLIER -108.05 119.92 40.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.685 -0.688 . . . . 1.53 109.472 178.799 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.505 HG13 ' HZ2' ' A' ' 834' ' ' TRP . 89.1 t -117.69 145.19 23.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.227 -0.442 . . . . 1.79 111.623 -178.648 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.461 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 4.7 tp10 -95.15 168.31 10.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.939 -0.573 . . . . 1.3999999999999999 110.742 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . 0.461 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -85.25 16.52 3.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 3.3399999999999999 110.993 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.09 -26.18 2.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.955 -0.566 . . . . 1.0900000000000001 111.117 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 39.2 m0 -52.85 120.36 5.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.067 -0.515 . . . . 0.34000000000000002 112.103 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . 0.811 HD22 ' HB3' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -94.05 160.4 14.73 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.54 -0.911 . . . . 1.8899999999999999 108.54 178.017 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.425 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 78.3 t80 -44.48 -34.86 2.22 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.542 0.21 . . . . 0.73999999999999999 111.245 -178.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.811 ' HB3' HD22 ' A' ' 790' ' ' ASN . 33.8 t70 -68.62 -51.28 44.01 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.855 -0.424 . . . . 2.0499999999999998 109.855 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . 0.556 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.9 OUTLIER -61.23 -31.73 71.52 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.176 -0.466 . . . . 1.0700000000000001 110.32 179.218 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.427 HD12 ' CZ2' ' A' ' 834' ' ' TRP . 29.8 tp -65.15 -52.98 51.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.648 -0.705 . . . . 1.55 110.198 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.682 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 31.0 mm -54.36 -28.85 19.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.535 -0.757 . . . . 1.0800000000000001 111.212 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 6.1 mtp -67.35 -50.36 60.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.688 0.28 . . . . 2.21 110.443 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -55.06 -54.34 44.29 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.067 0.46 . . . . 1.0900000000000001 110.144 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 65.4 mt -56.73 -51.01 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-N 115.765 -0.652 . . . . 1.1799999999999999 110.394 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.682 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.8 OUTLIER -56.48 -26.66 54.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.536 -0.756 . . . . 1.2 111.319 -179.764 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 800' ' ' SER . . . . . 0.545 ' HA ' ' HB2' ' A' ' 804' ' ' ASN . 0.5 OUTLIER -79.75 -24.64 41.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.372 -0.376 . . . . 1.52 111.194 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . 0.415 ' HB3' ' CE2' ' A' ' 781' ' ' PHE . 1.2 mptt -100.02 -6.78 25.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 2.73 111.334 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.599 HD11 ' HB2' ' A' ' 803' ' ' SER . 1.4 pp -109.05 -32.45 2.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.771 0.32 . . . . 1.4099999999999999 111.412 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.599 ' HB2' HD11 ' A' ' 802' ' ' ILE . 0.8 OUTLIER -152.78 79.5 1.21 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.383 -0.371 . . . . 2.0099999999999998 111.088 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . 0.545 ' HB2' ' HA ' ' A' ' 800' ' ' SER . 0.6 OUTLIER -169.83 92.93 0.24 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.195 -0.457 . . . . 3.3900000000000001 111.037 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -157.83 -69.53 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.167 -0.47 . . . . 4.5899999999999999 110.983 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -114.65 131.32 56.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 8.4399999999999995 110.677 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 8.6 m120 58.44 -169.17 0.13 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.148 -0.478 . . . . 6.8600000000000003 110.988 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -73.22 179.8 3.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 7.4100000000000001 110.936 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . 0.435 ' H ' HD21 ' A' ' 809' ' ' ASN . 2.3 p30 -78.66 141.1 38.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.046 -0.524 . . . . 7.1100000000000003 110.916 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 2.7 mt -88.68 -61.64 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 5.1699999999999999 111.021 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 1.8 p -159.79 81.38 2.44 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 2.2000000000000002 110.838 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . 0.512 ' HB2' HD22 ' A' ' 799' ' ' ASN . 42.8 Cg_endo -67.99 -162.34 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.541 2.16 . . . . 1.3799999999999999 112.215 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.502 HD11 HG22 ' A' ' 816' ' ' ILE . 9.4 pt -140.18 162.68 24.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.344 -0.389 . . . . 2.4399999999999999 111.155 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 5.8 p -129.09 -43.36 1.33 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.182 -0.463 . . . . 1.73 111.156 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.94 114.99 22.08 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.258 -0.428 . . . . 3.1299999999999999 110.925 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . 0.502 HG22 HD11 ' A' ' 813' ' ' ILE . 0.2 OUTLIER -135.75 176.18 8.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.267 -0.424 . . . . 1.52 111.443 -179.847 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.545 ' HE2' HG22 ' A' ' 827' ' ' VAL . 12.3 mmtt -128.16 136.39 51.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.959 -0.564 . . . . 1.4299999999999999 110.403 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.523 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 3.7 p90 -116.35 177.99 4.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.92 0.391 . . . . 1.24 111.421 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . 0.44 HE21 ' HA2' ' A' ' 823' ' ' GLY . 11.2 tp60 -100.1 111.3 23.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.001 -0.545 . . . . 2.0899999999999999 110.741 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.464 ' HB2' HG22 ' A' ' 826' ' ' VAL . 6.5 t70 -79.37 175.17 10.84 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.681 -0.691 . . . . 1.8 110.953 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.37 40.19 0.56 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.252 -0.431 . . . . 1.6200000000000001 111.09 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -140.28 15.7 2.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.342 -0.39 . . . . 1.6499999999999999 110.781 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . 0.44 ' HA2' HE21 ' A' ' 819' ' ' GLN . . . 58.3 54.13 40.15 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.81 -0.71 . . . . 0.88 112.23 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -172.75 133.51 0.58 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.925 0.393 . . . . 1.8600000000000001 110.658 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.523 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 67.0 m-85 -66.37 142.77 57.5 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.013 -0.54 . . . . 0.80000000000000004 110.704 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.487 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.3 OUTLIER -133.42 172.34 16.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 1.73 110.714 179.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . 0.545 HG22 ' HE2' ' A' ' 817' ' ' LYS . 1.8 t -98.78 113.07 32.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 1.21 111.153 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.539 HD23 ' HB2' ' A' ' 834' ' ' TRP . 0.9 OUTLIER -79.68 116.93 20.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.747 -0.661 . . . . 1.52 110.896 -179.745 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -65.72 -64.25 3.55 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.866 -0.683 . . . . 1.0900000000000001 112.615 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 830' ' ' SER . . . . . 0.435 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -171.36 -142.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.533 0.206 . . . . 1.8 110.629 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.566 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 11.1 t70 -57.08 -15.1 4.6 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.724 0.297 . . . . 2.2000000000000002 111.168 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -73.62 0.21 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.438 -0.347 . . . . 2.21 111.021 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.489 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 0.6 OUTLIER -60.74 -12.49 10.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.396 -0.366 . . . . 0.72999999999999998 110.646 179.793 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.539 ' HB2' HD23 ' A' ' 828' ' ' LEU . 3.7 t-105 -85.36 -39.85 17.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.385 -0.371 . . . . 0.29999999999999999 110.145 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . 0.723 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -69.43 -35.42 75.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.133 0.492 . . . . 2.8500000000000001 109.879 178.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 25.2 t -73.46 -55.19 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.625 -0.716 . . . . 1.4399999999999999 110.071 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -55.8 -27.64 52.2 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.058 -0.519 . . . . 1.04 110.374 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.723 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.3 mtmt -66.92 -47.92 70.26 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.972 -0.558 . . . . 1.3600000000000001 110.22 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -62.64 -32.64 73.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.042 -0.526 . . . . 1.95 109.946 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -64.63 -31.32 72.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.732 -0.667 . . . . 1.0900000000000001 110.119 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.762 HD22 ' HB3' ' A' ' 846' ' ' GLU . 1.5 mt -72.02 -42.69 66.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.788 -0.642 . . . . 1.1799999999999999 110.814 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.468 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -69.25 -20.52 63.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.463 . . . . 1.1799999999999999 111.197 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -68.07 3.61 1.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.489 . . . . 1.6799999999999999 110.577 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.468 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.12 20.06 0.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 1.96 110.901 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 58.62 19.08 6.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 2.4700000000000002 111.006 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.762 ' HB3' HD22 ' A' ' 841' ' ' LEU . 2.3 mt-10 -71.59 143.03 49.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 2.2999999999999998 110.816 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -136.09 14.59 3.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 2.46 110.751 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.528 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 19.6 m-85 -119.49 128.62 54.14 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.139 -0.482 . . . . 1.52 111.251 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.561 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.4 OUTLIER -115.46 129.06 56.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.005 -0.543 . . . . 1.3799999999999999 110.724 179.821 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -94.81 142.32 27.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.089 -0.505 . . . . 1.5600000000000001 111.183 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.738 HD13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -134.88 172.0 16.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.52 -0.309 . . . . 1.73 111.235 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.46 -32.81 2.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.703 0.287 . . . . 5.6399999999999997 111.184 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 55.26 34.04 21.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.277 -0.42 . . . . 2.8900000000000001 111.053 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 1.1 p90 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.26 -0.876 . . . . 3.3900000000000001 110.984 -179.933 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 N-CA-C 112.48 -0.248 . . . . 9.4199999999999999 112.48 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 55.77 68.55 0.85 Allowed 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.775 0.321 . . . . 8.4800000000000004 111.035 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.6 102.8 9.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 8.6400000000000006 110.822 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 104.08 167.72 25.0 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.87 -0.681 . . . . 4.2800000000000002 112.447 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.64 -59.76 1.94 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.74 0.305 . . . . 3.0 111.088 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.446 HG23 ' CG ' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -128.16 -168.16 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.426 . . . . 1.75 111.097 -179.773 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.534 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -139.83 82.91 1.9 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.043 0.449 . . . . 1.3600000000000001 109.805 179.665 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.618 HG23 ' HB3' ' A' ' 848' ' ' PHE . 0.1 OUTLIER -97.86 121.65 40.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.867 -0.606 . . . . 1.1899999999999999 111.458 -178.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . 0.445 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -112.58 -163.67 0.87 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.651 -0.704 . . . . 2.1499999999999999 110.629 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.97 101.89 7.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.161 -0.472 . . . . 1.53 110.341 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 31.4 m -93.36 165.13 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.985 -0.552 . . . . 1.79 111.341 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.465 ' HG3' ' HE3' ' A' ' 787' ' ' LYS . 0.9 OUTLIER -116.99 175.57 5.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 1.3999999999999999 111.028 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . 0.465 ' HE3' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -89.17 54.89 3.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.181 0.515 . . . . 3.3399999999999999 110.735 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -168.31 -26.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.649 -0.705 . . . . 1.0900000000000001 110.587 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 27.3 m0 -52.08 126.11 17.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.693 -0.685 . . . . 0.34000000000000002 111.923 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . 0.494 HD21 ' H ' ' A' ' 793' ' ' ASP . 0.1 OUTLIER -95.25 165.86 12.18 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.944 -0.761 . . . . 1.8899999999999999 108.944 178.314 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.4 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 92.0 t80 -51.42 -24.9 5.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.901 0.381 . . . . 0.73999999999999999 110.297 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.61 ' O ' ' HG3' ' A' ' 796' ' ' MET . 1.5 m-20 -70.5 -62.89 1.22 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.017 -0.538 . . . . 2.0499999999999998 109.74 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . 0.494 ' H ' HD21 ' A' ' 790' ' ' ASN . 1.0 OUTLIER -53.34 -29.26 33.17 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.112 0.482 . . . . 1.0700000000000001 110.336 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.474 HD13 ' CZ2' ' A' ' 834' ' ' TRP . 26.5 tp -67.96 -53.61 24.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.784 -0.644 . . . . 1.55 110.235 179.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.625 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 21.9 mm -60.09 -30.9 46.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.599 -0.728 . . . . 1.0800000000000001 111.211 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.61 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 21.3 mtp -69.13 -51.79 34.82 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.339 -0.245 . . . . 2.21 110.339 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.32 -52.01 62.88 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.014 0.435 . . . . 1.0900000000000001 110.067 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.439 ' O ' HG23 ' A' ' 802' ' ' ILE . 71.5 mt -58.53 -52.48 59.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.636 -0.711 . . . . 1.1799999999999999 110.423 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.631 ' HA ' HG12 ' A' ' 802' ' ' ILE . 7.0 t-20 -56.64 -21.59 28.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.614 -0.721 . . . . 1.2 111.215 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 22.3 t -79.29 -31.42 43.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 1.52 110.618 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -94.91 -8.63 36.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.96 -0.564 . . . . 2.73 111.245 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.769 HD12 HG12 ' A' ' 813' ' ' ILE . 1.3 pt -111.03 -23.94 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.476 -0.329 . . . . 1.4099999999999999 111.36 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.515 ' N ' HG13 ' A' ' 802' ' ' ILE . 3.8 t -148.33 58.25 1.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 2.0099999999999998 110.928 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -62.18 -49.79 74.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.151 -0.477 . . . . 3.3900000000000001 110.763 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.04 125.14 26.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 4.5899999999999999 111.139 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -91.79 -13.94 30.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 8.4399999999999995 110.9 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -99.1 177.2 5.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.124 -0.489 . . . . 6.8600000000000003 111.066 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 59.75 -92.51 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.925 -0.579 . . . . 7.4100000000000001 111.273 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . 0.443 ' O ' HG22 ' A' ' 810' ' ' ILE . 21.9 m-20 -106.49 147.68 29.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.866 0.365 . . . . 7.1100000000000003 111.006 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 809' ' ' ASN . 1.0 OUTLIER -149.63 120.45 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.047 -0.524 . . . . 5.1699999999999999 111.073 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -159.7 79.02 2.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 2.2000000000000002 110.854 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . 0.613 ' HA ' HD13 ' A' ' 802' ' ' ILE . 79.2 Cg_endo -77.26 -174.77 2.33 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.661 2.24 . . . . 1.3799999999999999 112.427 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.769 HG12 HD12 ' A' ' 802' ' ' ILE . 35.0 pt -135.77 174.34 12.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.022 -0.535 . . . . 2.4399999999999999 111.046 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.4 -60.75 0.31 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.238 -0.437 . . . . 1.73 111.057 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 1.5 tttp -92.44 126.81 37.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.293 -0.412 . . . . 3.1299999999999999 110.464 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . 0.602 HG21 HD11 ' A' ' 813' ' ' ILE . 1.2 pp -154.09 179.17 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 1.52 111.564 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.735 ' H ' ' HB2' ' A' ' 852' ' ' ARG . 5.9 mttt -109.42 -178.35 3.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 1.4299999999999999 110.215 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.534 ' HB2' HD12 ' A' ' 849' ' ' LEU . 15.3 p90 -156.38 164.11 38.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.716 0.293 . . . . 1.24 111.048 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . 0.438 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.7 OUTLIER -83.53 103.16 12.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.114 0.483 . . . . 2.0899999999999999 110.605 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -79.6 176.31 9.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.638 -0.71 . . . . 1.8 110.982 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . 0.465 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.2 OUTLIER -82.93 27.53 0.54 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 1.6200000000000001 110.954 179.925 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.39 -0.52 14.47 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.239 -0.437 . . . . 1.6499999999999999 110.775 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 84.12 16.69 66.63 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.767 -0.73 . . . . 0.88 112.436 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -143.72 -145.41 0.17 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.743 0.306 . . . . 1.8600000000000001 110.561 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.463 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 97.4 m-85 -129.95 145.95 51.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.965 0.412 . . . . 0.80000000000000004 111.602 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.546 HG13 ' N ' ' A' ' 827' ' ' VAL . 10.0 t -122.55 163.99 20.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.645 -0.707 . . . . 1.73 109.722 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . 0.546 ' N ' HG13 ' A' ' 826' ' ' VAL . 0.2 OUTLIER -97.65 107.52 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.065 0.459 . . . . 1.21 111.296 -179.453 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 5.6 tt -79.6 136.8 36.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.652 -0.704 . . . . 1.52 110.723 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -90.88 -59.39 1.41 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.654 -0.784 . . . . 1.0900000000000001 112.495 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 830' ' ' SER . . . . . 0.441 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.2 OUTLIER -170.5 -141.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.358 -0.238 . . . . 1.8 110.358 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.441 ' H ' ' HB3' ' A' ' 830' ' ' SER . 6.9 t0 -55.96 -23.52 32.69 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.666 0.27 . . . . 2.2000000000000002 110.896 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -64.88 -73.74 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.294 -0.412 . . . . 2.21 110.806 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.424 ' O ' ' HB1' ' A' ' 837' ' ' ALA . 0.4 OUTLIER -60.2 -12.59 9.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.301 -0.409 . . . . 0.72999999999999998 110.636 179.63 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.483 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.5 t-105 -81.37 -39.65 24.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.983 0.42 . . . . 0.29999999999999999 109.961 179.013 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -73.55 -28.87 62.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.999 -0.546 . . . . 2.8500000000000001 109.68 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 24.4 t -75.48 -53.99 14.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.585 -0.734 . . . . 1.4399999999999999 109.706 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.424 ' HB1' ' O ' ' A' ' 833' ' ' ASP . . . -57.81 -29.63 65.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.661 -0.7 . . . . 1.04 110.457 178.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -67.46 -45.43 75.99 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.051 -0.522 . . . . 1.3600000000000001 110.518 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -61.76 -25.23 67.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.001 -0.545 . . . . 1.95 110.326 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 840' ' ' MET . . . . . 0.465 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 18.1 ttp -75.67 -38.44 58.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.68 -0.691 . . . . 1.0900000000000001 110.418 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 12.1 mt -62.76 -53.2 57.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.044 -0.526 . . . . 1.1799999999999999 110.806 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.46 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -62.53 -22.51 66.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 1.1799999999999999 111.039 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -67.7 3.37 1.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.077 -0.51 . . . . 1.6799999999999999 110.661 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.46 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.98 22.57 0.44 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.465 . . . . 1.96 110.935 -180.0 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.7 m120 58.09 19.67 6.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.1 -0.5 . . . . 2.4700000000000002 111.208 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.447 ' OE2' ' HB2' ' A' ' 844' ' ' ASN . 0.1 OUTLIER -82.0 148.48 28.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.296 -0.411 . . . . 2.2999999999999998 110.635 179.803 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -141.68 11.04 2.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 2.46 110.97 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.618 ' HB3' HG23 ' A' ' 782' ' ' THR . 64.9 m-85 -107.18 126.3 52.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.118 -0.492 . . . . 1.52 110.733 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.534 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.3 OUTLIER -123.68 126.56 46.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.232 -0.44 . . . . 1.3799999999999999 111.09 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.449 ' C ' HG12 ' A' ' 851' ' ' ILE . 21.2 m-20 -88.12 -176.3 5.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.051 -0.522 . . . . 1.5600000000000001 110.732 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.534 HD12 ' HB3' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -136.17 -176.15 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.811 0.339 . . . . 1.73 111.599 -179.953 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.735 ' HB2' ' H ' ' A' ' 817' ' ' LYS . 7.1 ttp180 -53.51 -78.8 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 5.6399999999999997 110.846 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . 0.418 ' H ' ' HB3' ' A' ' 852' ' ' ARG . 0.2 OUTLIER 43.15 51.35 5.61 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.407 -0.36 . . . . 2.8900000000000001 111.438 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . 0.481 ' HD1' ' HG2' ' A' ' 852' ' ' ARG . 4.7 m-85 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.222 -0.894 . . . . 3.3900000000000001 110.865 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.324 0 N-CA-C 112.409 -0.276 . . . . 9.4199999999999999 112.409 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 55.63 49.56 16.22 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.913 0.387 . . . . 8.4800000000000004 111.131 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 14.5 mtp -76.8 -41.34 44.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 8.6400000000000006 110.823 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 153.12 136.73 2.39 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 4.2800000000000002 112.521 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.55 20.31 16.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.793 0.33 . . . . 3.0 110.779 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.528 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER -121.27 173.68 6.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 1.75 111.151 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.433 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.13 92.32 1.42 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.128 0.49 . . . . 1.3600000000000001 110.025 179.617 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.4 96.3 8.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.818 -0.628 . . . . 1.1899999999999999 110.729 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.38 132.14 44.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.674 -0.694 . . . . 2.1499999999999999 111.128 -179.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . 0.61 HD13 ' HD2' ' A' ' 847' ' ' LYS . 8.5 tt -65.87 107.01 1.69 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.092 -0.504 . . . . 1.53 110.392 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 28.3 m -102.01 173.92 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.521 . . . . 1.79 111.357 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 0.7 OUTLIER -119.4 170.33 9.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 1.3999999999999999 110.833 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . 0.445 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -83.46 14.86 3.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 3.3399999999999999 111.026 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 1.6 p -127.35 -27.44 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.922 -0.581 . . . . 1.0900000000000001 110.909 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -47.92 125.11 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.922 -0.581 . . . . 0.34000000000000002 112.007 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.74 165.93 12.46 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.134 -0.691 . . . . 1.8899999999999999 109.134 178.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -50.98 -26.42 5.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.023 0.439 . . . . 0.73999999999999999 110.213 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.616 ' O ' ' HG3' ' A' ' 796' ' ' MET . 14.0 t70 -71.89 -61.41 1.8 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.863 -0.608 . . . . 2.0499999999999998 109.577 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -53.79 -24.12 14.27 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.07 -0.514 . . . . 1.0700000000000001 110.128 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.55 ' HG ' HD12 ' A' ' 798' ' ' ILE . 32.5 tp -73.56 -57.34 4.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 1.55 110.497 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.683 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.2 mm -58.0 -33.7 46.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.689 -0.687 . . . . 1.0800000000000001 111.901 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.616 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 3.3 mtp -72.32 -44.42 62.7 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.107 -0.237 . . . . 2.21 111.001 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -61.78 -47.29 85.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.167 0.508 . . . . 1.0900000000000001 109.738 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.55 HD12 ' HG ' ' A' ' 794' ' ' LEU . 17.5 mt -63.39 -49.64 81.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.478 -0.783 . . . . 1.1799999999999999 110.126 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.683 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.6 OUTLIER -57.77 -23.76 53.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.838 -0.619 . . . . 1.2 110.909 179.568 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 800' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 804' ' ' ASN . 0.7 OUTLIER -80.19 -27.74 38.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 1.52 110.6 179.769 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -97.82 -4.18 37.31 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.052 -0.522 . . . . 2.73 111.394 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.583 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.2 pp -113.8 -31.16 2.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.7 0.286 . . . . 1.4099999999999999 111.422 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.467 ' N ' HG13 ' A' ' 802' ' ' ILE . 1.2 m -154.8 90.12 1.28 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.926 0.393 . . . . 2.0099999999999998 111.139 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 800' ' ' SER . 9.5 t-20 -130.71 -8.94 4.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.059 -0.519 . . . . 3.3900000000000001 110.793 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 805' ' ' THR . . . . . 0.461 HG23 ' H ' ' A' ' 807' ' ' ASN . 1.9 m -66.46 156.15 35.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.104 -0.498 . . . . 4.5899999999999999 111.134 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -103.88 -20.46 13.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 8.4399999999999995 110.843 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . 0.461 ' H ' HG23 ' A' ' 805' ' ' THR . 0.6 OUTLIER -79.48 137.96 37.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.118 -0.492 . . . . 6.8600000000000003 111.045 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . 0.426 ' HB3' ' H ' ' A' ' 809' ' ' ASN . 32.0 m-80 56.9 -166.12 0.14 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.034 -0.53 . . . . 7.4100000000000001 111.143 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . 0.426 ' H ' ' HB3' ' A' ' 808' ' ' ASN . 12.1 t30 -76.61 -174.96 3.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.09 -0.505 . . . . 7.1100000000000003 110.837 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . 0.516 HG13 ' H ' ' A' ' 811' ' ' SER . 2.8 pt -142.38 -50.39 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 5.1699999999999999 111.171 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 811' ' ' SER . . . . . 0.516 ' H ' HG13 ' A' ' 810' ' ' ILE . 19.6 m 55.33 76.98 0.45 Allowed Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.198 -0.456 . . . . 2.2000000000000002 110.995 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . 0.521 ' HB2' HD22 ' A' ' 799' ' ' ASN . 53.7 Cg_endo -69.91 -171.76 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.529 2.153 . . . . 1.3799999999999999 112.53 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.433 HG12 HD13 ' A' ' 802' ' ' ILE . 3.4 pt -145.0 163.57 13.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.162 -0.472 . . . . 2.4399999999999999 111.1 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 1.2 p -133.16 -63.01 0.78 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.313 -0.403 . . . . 1.73 111.275 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -82.14 126.11 31.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 3.1299999999999999 110.96 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . 0.514 HG21 ' HA ' ' A' ' 853' ' ' LEU . 1.2 pp -153.53 174.88 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 1.52 111.212 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.473 ' HE3' ' OH ' ' A' ' 854' ' ' TYR . 15.0 mttt -115.37 152.99 31.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 1.4299999999999999 110.81 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' A' ' 828' ' ' LEU . 6.9 p90 -129.35 179.26 5.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.379 -0.373 . . . . 1.24 110.898 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . 0.498 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -92.86 115.7 28.36 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.461 0.648 . . . . 2.0899999999999999 110.748 179.906 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.483 ' HB2' HG13 ' A' ' 826' ' ' VAL . 7.8 t70 -93.18 177.45 6.05 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 114.859 -1.064 . . . . 1.8 111.132 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -78.92 13.31 1.78 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.103 -0.499 . . . . 1.6200000000000001 111.113 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.48 4.7 46.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.427 . . . . 1.6499999999999999 110.628 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 75.72 10.48 84.85 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.914 -0.66 . . . . 0.88 112.475 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.64 -149.85 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.752 0.31 . . . . 1.8600000000000001 110.472 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.404 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 48.5 m-85 -128.41 139.75 52.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.384 -0.371 . . . . 0.80000000000000004 110.913 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.483 HG13 ' HB2' ' A' ' 820' ' ' ASP . 8.9 m -123.39 173.15 9.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.419 -0.355 . . . . 1.73 110.745 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -98.75 123.53 51.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.036 0.446 . . . . 1.21 111.492 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.468 HD11 ' HB2' ' A' ' 834' ' ' TRP . 5.3 tp -81.76 109.73 16.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 1.52 110.723 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -64.5 -60.72 6.7 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.811 -0.709 . . . . 1.0900000000000001 112.644 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 830' ' ' SER . . . . . 0.536 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -171.23 -142.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.476 -0.194 . . . . 1.8 110.476 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.536 ' H ' ' HB3' ' A' ' 830' ' ' SER . 6.0 p-10 -61.67 -15.4 39.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.896 0.379 . . . . 2.2000000000000002 110.91 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -73.72 -68.8 0.48 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.229 -0.441 . . . . 2.21 110.784 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.516 ' O ' ' HB1' ' A' ' 837' ' ' ALA . 1.7 m-20 -61.18 -13.52 18.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.308 -0.405 . . . . 0.72999999999999998 110.546 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.527 ' HZ3' ' HG ' ' A' ' 849' ' ' LEU . 2.2 t-105 -81.72 -47.48 12.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.198 -0.455 . . . . 0.29999999999999999 110.037 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.31 -32.92 74.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.982 -0.554 . . . . 2.8500000000000001 109.877 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 58.9 t -74.04 -53.93 16.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.474 -0.785 . . . . 1.4399999999999999 109.97 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.516 ' HB1' ' O ' ' A' ' 833' ' ' ASP . . . -53.39 -28.43 29.36 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.03 -0.532 . . . . 1.04 110.185 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.521 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 2.0 mtpp -67.73 -47.9 68.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.765 -0.652 . . . . 1.3600000000000001 110.366 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -60.17 -28.44 67.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.073 -0.512 . . . . 1.95 110.205 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 19.4 ttp -69.92 -39.44 76.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.825 -0.625 . . . . 1.0900000000000001 110.278 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 26.6 mt -66.59 -48.87 68.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.923 -0.58 . . . . 1.1799999999999999 110.705 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.436 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -63.02 -23.47 67.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 1.1799999999999999 110.957 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.36 -0.81 2.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.039 -0.528 . . . . 1.6799999999999999 110.452 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.436 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -144.41 20.36 1.71 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.8 -0.637 . . . . 1.96 110.637 179.762 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.66 25.06 14.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.976 -0.556 . . . . 2.4700000000000002 111.238 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -85.48 171.85 11.46 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.48 -0.327 . . . . 2.2999999999999998 110.727 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . 0.61 ' HD2' HD13 ' A' ' 784' ' ' LEU . 15.3 pttt -159.85 11.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.31 -0.405 . . . . 2.46 111.414 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.45 ' HE1' HD11 ' A' ' 784' ' ' LEU . 29.4 m-85 -120.83 124.39 44.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.893 0.377 . . . . 1.52 111.068 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.527 ' HG ' ' HZ3' ' A' ' 834' ' ' TRP . 0.7 OUTLIER -101.82 116.24 32.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.06 -0.518 . . . . 1.3799999999999999 110.178 179.55 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.498 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 7.2 m120 -72.16 162.69 29.11 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.058 -0.519 . . . . 1.5600000000000001 111.302 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.528 ' O ' ' HA ' ' A' ' 780' ' ' ILE . 3.5 mm -141.51 152.67 19.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.208 -0.451 . . . . 1.73 111.029 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.599 ' HB3' ' HD1' ' A' ' 854' ' ' TYR . 0.0 OUTLIER -104.84 -28.22 11.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.469 -0.332 . . . . 5.6399999999999997 110.501 179.646 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . 0.514 ' HA ' HG21 ' A' ' 816' ' ' ILE . 1.0 OUTLIER 56.22 23.55 7.19 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.005 -0.543 . . . . 2.8900000000000001 111.014 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . 0.599 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.21 -0.9 . . . . 3.3900000000000001 110.961 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.133 0 N-CA-C 112.451 -0.26 . . . . 9.4199999999999999 112.451 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -136.92 131.31 32.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.885 0.374 . . . . 8.4800000000000004 111.141 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 15.1 mtt -80.83 141.58 34.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.162 -0.472 . . . . 8.6400000000000006 110.838 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -137.34 -3.54 2.13 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.852 -0.689 . . . . 4.2800000000000002 112.385 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 47.9 t -103.3 104.85 15.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.744 0.307 . . . . 3.0 110.977 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.84 ' HA ' ' HG ' ' A' ' 853' ' ' LEU . 0.2 OUTLIER -131.07 -157.71 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.276 -0.42 . . . . 1.75 111.029 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.612 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -144.37 87.15 1.86 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.089 0.471 . . . . 1.3600000000000001 110.078 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.441 HG23 ' OD1' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -98.19 91.69 5.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.655 -0.702 . . . . 1.1899999999999999 111.229 -179.336 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.17 144.61 26.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.804 -0.634 . . . . 2.1499999999999999 110.956 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . 0.401 ' HB2' ' HE1' ' A' ' 848' ' ' PHE . 1.2 tt -85.01 114.45 22.18 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.252 -0.431 . . . . 1.53 110.316 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 34.9 m -98.51 -173.69 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.92 -0.582 . . . . 1.79 111.497 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.615 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 3.9 tp10 -133.86 167.92 19.69 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.952 -0.567 . . . . 1.3999999999999999 110.676 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . 0.615 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -82.8 49.52 1.51 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.253 -0.43 . . . . 3.3399999999999999 110.781 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -166.09 -25.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.138 -0.483 . . . . 1.0900000000000001 110.987 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -52.65 123.86 12.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.855 -0.612 . . . . 0.34000000000000002 111.922 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . 0.446 HD21 ' HB2' ' A' ' 792' ' ' ASP . 0.0 OUTLIER -92.23 168.76 11.11 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.804 -0.813 . . . . 1.8899999999999999 108.804 178.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.427 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 63.3 t80 -53.56 -26.11 20.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.139 0.495 . . . . 0.73999999999999999 110.252 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.583 ' O ' ' HG3' ' A' ' 796' ' ' MET . 2.5 m-20 -70.18 -63.72 1.03 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.694 -0.685 . . . . 2.0499999999999998 109.766 178.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.97 -29.8 31.11 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.223 -0.444 . . . . 1.0700000000000001 110.323 179.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.471 HD12 ' CZ2' ' A' ' 834' ' ' TRP . 30.2 tp -66.86 -54.32 23.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.824 -0.626 . . . . 1.55 110.429 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.654 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.9 mm -59.52 -33.06 50.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.639 -0.709 . . . . 1.0800000000000001 111.621 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.583 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 4.7 mtt -68.28 -52.78 29.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.657 0.265 . . . . 2.21 110.499 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.42 -52.89 57.93 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.203 -0.453 . . . . 1.0900000000000001 110.039 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.472 ' O ' HG12 ' A' ' 802' ' ' ILE . 93.4 mt -57.05 -52.39 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.757 -0.656 . . . . 1.1799999999999999 110.583 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.659 ' HA ' HG12 ' A' ' 802' ' ' ILE . 1.1 t-20 -54.68 -29.82 53.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.502 -0.772 . . . . 1.2 111.379 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 29.5 t -75.88 -26.25 56.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.468 -0.333 . . . . 1.52 111.017 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -101.57 -0.43 34.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.273 -0.422 . . . . 2.73 111.566 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.659 HG12 ' HA ' ' A' ' 799' ' ' ASN . 14.0 pt -117.01 -26.38 2.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.681 0.276 . . . . 1.4099999999999999 111.628 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 21.6 p -121.92 34.25 5.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.979 0.419 . . . . 2.0099999999999998 111.124 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -68.0 176.55 2.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.042 -0.526 . . . . 3.3900000000000001 110.951 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.44 31.17 0.83 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.11 -0.495 . . . . 4.5899999999999999 111.164 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -127.23 -27.56 2.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 8.4399999999999995 110.905 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -86.64 179.2 6.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 6.8600000000000003 110.862 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -100.05 -24.35 14.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.081 -0.509 . . . . 7.4100000000000001 110.872 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -63.09 106.08 0.8 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.309 -0.405 . . . . 7.1100000000000003 110.872 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.88 -27.29 5.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 5.1699999999999999 111.201 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 1.3 t -90.54 123.63 64.77 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 2.2000000000000002 110.851 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . 0.448 ' HB2' HD22 ' A' ' 799' ' ' ASN . 68.9 Cg_endo -74.05 -179.23 4.46 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.546 2.164 . . . . 1.3799999999999999 112.284 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.407 HD12 HG22 ' A' ' 813' ' ' ILE . 2.1 mt -128.52 151.48 35.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.095 -0.502 . . . . 2.4399999999999999 111.364 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.39 -71.44 0.74 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.021 -0.536 . . . . 1.73 110.834 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -83.88 131.62 34.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 3.1299999999999999 110.592 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -151.61 -174.72 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.307 -0.406 . . . . 1.52 111.448 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.562 ' H ' ' HG3' ' A' ' 852' ' ' ARG . 17.2 mttt -116.21 175.38 5.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.567 . . . . 1.4299999999999999 110.173 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.611 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 22.7 p90 -148.44 166.28 28.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.921 0.391 . . . . 1.24 111.112 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . 0.43 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 1.9 tp60 -96.39 108.45 20.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 2.0899999999999999 110.577 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.402 ' HB3' ' CG2' ' A' ' 826' ' ' VAL . 0.1 OUTLIER -79.12 -178.2 6.03 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.756 -0.657 . . . . 1.8 111.064 -179.834 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . 0.523 ' HG2' ' HG3' ' A' ' 840' ' ' MET . 3.2 pt-20 -87.2 33.99 0.68 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.277 -0.42 . . . . 1.6200000000000001 111.59 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -139.17 14.93 2.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.36 -0.382 . . . . 1.6499999999999999 110.735 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 59.84 59.13 11.05 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.842 -0.694 . . . . 0.88 112.237 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -169.36 132.59 1.28 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.965 0.412 . . . . 1.8600000000000001 110.493 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.848 ' HB2' ' HH ' ' A' ' 854' ' ' TYR . 49.4 m-85 -73.9 126.51 30.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 0.80000000000000004 111.018 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.611 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 1.3 t -108.27 170.62 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.903 -0.59 . . . . 1.73 111.076 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 1.4 t -99.65 107.0 19.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.33 -0.396 . . . . 1.21 111.197 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.89 110.19 18.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.53 . . . . 1.52 110.736 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -62.42 -65.11 3.36 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.858 -0.686 . . . . 1.0900000000000001 112.605 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 85.1 p -170.2 -131.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.495 -0.187 . . . . 1.8 110.495 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -62.8 -11.57 18.73 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.786 0.327 . . . . 2.2000000000000002 110.906 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -79.07 -68.95 0.61 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.236 -0.438 . . . . 2.21 110.954 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.537 ' O ' ' HB1' ' A' ' 837' ' ' ALA . 0.3 OUTLIER -62.85 -11.99 21.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.297 -0.41 . . . . 0.72999999999999998 110.568 179.714 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.471 ' CZ2' HD12 ' A' ' 794' ' ' LEU . 0.9 OUTLIER -81.31 -45.2 16.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.309 -0.405 . . . . 0.29999999999999999 110.019 179.267 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.69 -36.18 80.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.958 -0.564 . . . . 2.8500000000000001 109.957 178.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 87.9 t -70.2 -53.88 21.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.51 -0.768 . . . . 1.4399999999999999 110.06 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.537 ' HB1' ' O ' ' A' ' 833' ' ' ASP . . . -57.21 -25.06 58.45 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.086 -0.507 . . . . 1.04 109.981 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 1.4 mtpp -65.4 -49.34 69.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.799 -0.637 . . . . 1.3600000000000001 110.096 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.37 -27.07 67.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.866 -0.606 . . . . 1.95 110.449 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 840' ' ' MET . . . . . 0.523 ' HG3' ' HG2' ' A' ' 821' ' ' GLU . 10.8 ttp -74.34 -38.23 63.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.945 -0.57 . . . . 1.0900000000000001 110.515 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.619 HD22 ' HB3' ' A' ' 846' ' ' GLU . 14.3 mt -63.13 -42.24 99.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.085 -0.507 . . . . 1.1799999999999999 110.757 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.486 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -68.16 -23.86 64.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.506 . . . . 1.1799999999999999 111.324 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.41 4.21 1.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 1.6799999999999999 110.639 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.486 ' H ' ' C ' ' A' ' 842' ' ' ALA . 35.5 m-80 -151.88 14.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 1.96 110.867 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.9 m120 62.25 14.9 7.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.148 -0.478 . . . . 2.4700000000000002 111.291 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.619 ' HB3' HD22 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -68.04 169.61 9.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.389 . . . . 2.2999999999999998 110.864 179.725 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.62 -30.67 0.17 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.337 -0.392 . . . . 2.46 111.036 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.401 ' HE1' ' HB2' ' A' ' 784' ' ' LEU . 26.0 m-85 -79.53 149.51 31.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.297 -0.411 . . . . 1.52 110.667 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.477 HD11 ' HB2' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -136.27 114.71 11.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.219 -0.446 . . . . 1.3799999999999999 111.161 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.441 ' OD1' HG23 ' A' ' 782' ' ' THR . 24.8 m-20 -72.36 173.41 8.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.292 -0.413 . . . . 1.5600000000000001 110.718 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.612 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -133.77 178.0 6.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.414 -0.357 . . . . 1.73 111.492 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.562 ' HG3' ' H ' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -40.21 -70.59 0.1 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.011 -0.541 . . . . 5.6399999999999997 111.654 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . 0.84 ' HG ' ' HA ' ' A' ' 780' ' ' ILE . 0.2 OUTLIER 59.11 22.05 10.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.886 -0.597 . . . . 2.8900000000000001 109.971 -178.894 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . 0.848 ' HH ' ' HB2' ' A' ' 825' ' ' PHE . 30.1 m-85 . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.194 -0.908 . . . . 3.3900000000000001 110.819 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . 0.413 ' H3 ' ' H ' ' A' ' 776' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 112.617 -0.193 . . . . 9.4199999999999999 112.617 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . 0.413 ' H ' ' H3 ' ' A' ' 775' ' ' GLY . . . 57.67 83.7 0.11 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.873 0.368 . . . . 8.4800000000000004 111.078 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 1.8 ptp -140.22 -177.45 5.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.164 -0.471 . . . . 8.6400000000000006 110.939 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 169.98 -166.19 39.45 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.796 -0.716 . . . . 4.2800000000000002 112.708 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 11.4 m -104.73 131.82 51.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.804 0.335 . . . . 3.0 111.016 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.466 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER -120.78 172.31 8.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.463 . . . . 1.75 110.792 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.489 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -153.86 89.7 1.33 Allowed 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.919 0.39 . . . . 1.3600000000000001 110.399 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.594 HG21 ' HB3' ' A' ' 848' ' ' PHE . 0.1 OUTLIER -98.36 93.17 6.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.985 -0.552 . . . . 1.1899999999999999 111.111 -179.564 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.76 161.08 14.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.69 -0.686 . . . . 2.1499999999999999 110.886 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . 0.431 HD12 ' HB2' ' A' ' 847' ' ' LYS . 0.3 OUTLIER -96.56 111.79 23.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 1.53 110.269 179.448 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 30.0 m -97.52 -171.41 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.101 -0.499 . . . . 1.79 111.433 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.406 ' O ' ' HD2' ' A' ' 838' ' ' LYS . 0.8 OUTLIER -138.78 170.86 15.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.045 -0.525 . . . . 1.3999999999999999 110.838 -179.771 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . 0.436 ' HE3' ' HB1' ' A' ' 842' ' ' ALA . 15.4 mmtt -85.76 49.98 1.88 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.055 0.455 . . . . 3.3399999999999999 110.512 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.6 p -165.21 -27.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.947 -0.569 . . . . 1.0900000000000001 110.791 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 30.3 m0 -52.6 122.75 9.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.921 -0.582 . . . . 0.34000000000000002 111.85 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . 0.629 HD22 ' HB2' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -95.97 159.22 15.08 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.874 -0.787 . . . . 1.8899999999999999 108.874 178.372 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.481 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 86.4 t80 -44.52 -33.01 1.59 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.698 0.285 . . . . 0.73999999999999999 111.31 -178.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.629 ' HB2' HD22 ' A' ' 790' ' ' ASN . 2.3 m-20 -69.24 -51.91 32.89 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.925 -0.398 . . . . 2.0499999999999998 109.925 178.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . 0.579 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.6 OUTLIER -61.11 -29.53 69.82 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 120.995 0.426 . . . . 1.0700000000000001 110.247 179.205 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 34.2 tp -67.17 -52.32 42.82 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.825 -0.625 . . . . 1.55 110.384 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.655 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 32.8 mm -57.03 -29.09 30.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.549 -0.751 . . . . 1.0800000000000001 111.706 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.549 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 10.1 mtt -67.94 -53.43 26.35 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.668 0.271 . . . . 2.21 110.336 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.0 -54.35 36.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.144 -0.48 . . . . 1.0900000000000001 110.117 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.433 ' O ' HG21 ' A' ' 802' ' ' ILE . 68.5 mt -55.64 -51.1 62.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-N 115.765 -0.652 . . . . 1.1799999999999999 110.356 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.655 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.9 OUTLIER -56.06 -28.45 57.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.624 -0.716 . . . . 1.2 111.338 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 43.0 t -77.24 -23.51 51.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.278 -0.419 . . . . 1.52 110.875 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.07 0.24 27.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 2.73 111.414 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.567 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.7 pt -120.35 -22.21 3.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.571 -0.286 . . . . 1.4099999999999999 111.393 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.425 ' N ' HG13 ' A' ' 802' ' ' ILE . 8.7 t -136.79 40.41 2.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.389 -0.369 . . . . 2.0099999999999998 110.999 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -165.59 26.33 0.05 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.276 -0.42 . . . . 3.3900000000000001 111.022 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.91 -64.35 1.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 4.5899999999999999 110.979 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.71 170.08 12.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.295 -0.411 . . . . 8.4399999999999995 110.835 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -125.1 77.01 1.59 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 6.8600000000000003 111.008 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.17 -67.59 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 7.4100000000000001 110.89 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -129.09 138.71 52.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 7.1100000000000003 110.847 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 1.1 pt -103.38 150.41 6.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.123 -0.489 . . . . 5.1699999999999999 111.137 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -153.12 88.36 3.81 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 2.2000000000000002 110.996 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -76.23 137.53 19.18 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.463 2.109 . . . . 1.3799999999999999 112.257 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.459 HG13 ' CD1' ' A' ' 802' ' ' ILE . 2.3 mt -125.64 149.26 30.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.064 -0.516 . . . . 2.4399999999999999 111.337 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 2.9 p -122.89 -44.42 2.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.996 -0.547 . . . . 1.73 110.836 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.08 130.47 41.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 3.1299999999999999 110.712 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . 0.498 HG22 ' HA ' ' A' ' 853' ' ' LEU . 1.0 OUTLIER -152.08 168.54 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.972 0.415 . . . . 1.52 111.409 -179.708 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.447 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 16.7 mmtt -113.66 136.9 52.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.784 -0.644 . . . . 1.4299999999999999 110.385 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.597 ' HB2' HD12 ' A' ' 849' ' ' LEU . 4.2 p90 -114.85 173.32 6.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.811 0.338 . . . . 1.24 111.274 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -100.38 108.29 20.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.081 -0.509 . . . . 2.0899999999999999 110.504 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.842 ' HB2' HG23 ' A' ' 826' ' ' VAL . 4.1 t70 -79.08 173.6 12.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.824 -0.626 . . . . 1.8 110.829 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.11 10.09 2.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.245 -0.434 . . . . 1.6200000000000001 111.043 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.86 10.38 41.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 1.6499999999999999 110.848 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 61.71 51.73 55.46 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.859 -0.686 . . . . 0.88 112.468 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.96 141.87 0.27 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.024 0.44 . . . . 1.8600000000000001 110.429 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.481 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 63.6 m-85 -66.15 142.85 57.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.836 -0.62 . . . . 0.80000000000000004 110.488 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.842 HG23 ' HB2' ' A' ' 820' ' ' ASP . 0.2 OUTLIER -133.1 173.03 15.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.219 -0.446 . . . . 1.73 110.486 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.57 113.71 34.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.931 0.396 . . . . 1.21 111.42 -179.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.9 tt -80.25 115.7 19.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.776 -0.647 . . . . 1.52 110.952 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -61.52 -69.25 1.35 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.852 -0.69 . . . . 1.0900000000000001 112.549 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 830' ' ' SER . . . . . 0.439 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 1.2 p -170.51 -140.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 110.442 -0.207 . . . . 1.8 110.442 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.439 ' H ' ' HB2' ' A' ' 830' ' ' SER . 0.9 OUTLIER -55.61 -24.05 30.98 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.745 0.307 . . . . 2.2000000000000002 111.033 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -64.94 0.8 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.392 -0.367 . . . . 2.21 110.757 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.437 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 3.3 m-20 -61.83 -13.92 28.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.72999999999999998 110.641 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.481 ' HD1' ' N ' ' A' ' 791' ' ' PHE . 5.3 t-105 -86.58 -44.25 12.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.381 -0.372 . . . . 0.29999999999999999 110.192 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -64.84 -27.7 69.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.189 0.518 . . . . 2.8500000000000001 109.835 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 88.4 t -82.54 -58.32 3.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.474 -0.785 . . . . 1.4399999999999999 110.108 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.477 ' O ' ' HE2' ' A' ' 840' ' ' MET . . . -52.94 -30.96 37.64 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.135 -0.484 . . . . 1.04 110.533 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.406 ' HD2' ' O ' ' A' ' 786' ' ' GLU . 11.9 ttpt -69.66 -52.18 28.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.801 -0.636 . . . . 1.3600000000000001 109.979 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.32 -26.55 61.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.438 -0.801 . . . . 1.95 110.162 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 840' ' ' MET . . . . . 0.477 ' HE2' ' O ' ' A' ' 837' ' ' ALA . 12.3 ttp -70.83 -40.87 72.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.772 -0.649 . . . . 1.0900000000000001 110.232 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.459 ' HB3' ' O ' ' A' ' 846' ' ' GLU . 17.4 mt -62.27 -35.22 78.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.736 -0.665 . . . . 1.1799999999999999 110.814 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.476 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -73.82 -22.26 59.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.321 -0.399 . . . . 1.1799999999999999 111.178 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -69.77 6.27 1.22 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 1.6799999999999999 110.667 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.476 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.03 22.36 0.5 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.028 -0.533 . . . . 1.96 110.852 -179.902 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 58.05 16.12 3.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.102 -0.499 . . . . 2.4700000000000002 111.181 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.459 ' O ' ' HB3' ' A' ' 841' ' ' LEU . 3.7 mt-10 -82.72 140.39 33.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 2.2999999999999998 110.807 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . 0.431 ' HB2' HD12 ' A' ' 784' ' ' LEU . 0.1 OUTLIER -135.74 30.6 3.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 2.46 110.759 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.594 ' HB3' HG21 ' A' ' 782' ' ' THR . 8.9 m-85 -125.88 126.0 43.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.117 -0.492 . . . . 1.52 110.889 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.597 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.4 OUTLIER -115.36 117.77 31.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 1.3799999999999999 110.502 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.459 ' C ' HG12 ' A' ' 851' ' ' ILE . 1.9 m-20 -84.21 152.91 23.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.261 -0.427 . . . . 1.5600000000000001 111.481 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.489 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -134.95 165.88 29.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 116.088 -0.505 . . . . 1.73 111.19 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . . . . . . . . . 6.6 ttt85 -114.15 -31.07 6.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.318 -0.401 . . . . 5.6399999999999997 110.542 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . 0.498 ' HA ' HG22 ' A' ' 816' ' ' ILE . 1.8 mp 55.83 53.85 8.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.988 -0.551 . . . . 2.8900000000000001 111.293 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 1.2 p90 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.184 -0.912 . . . . 3.3900000000000001 110.906 179.858 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 N-CA-C 112.489 -0.244 . . . . 9.4199999999999999 112.489 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -163.34 -12.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.854 0.359 . . . . 8.4800000000000004 111.111 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 4.0 ptt? -104.66 24.84 11.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 8.6400000000000006 110.994 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -151.54 163.14 29.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.637 -0.792 . . . . 4.2800000000000002 112.694 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 58.68 87.22 0.08 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.917 0.389 . . . . 3.0 111.17 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -126.8 -166.78 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.032 -0.531 . . . . 1.75 110.702 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.697 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.2 OUTLIER -158.23 93.03 1.2 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.982 0.42 . . . . 1.3600000000000001 110.138 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.97 92.21 5.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.024 -0.535 . . . . 1.1899999999999999 110.989 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.08 139.89 30.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.741 -0.663 . . . . 2.1499999999999999 110.962 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 6.4 tt -72.32 104.21 3.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.935 0.398 . . . . 1.53 110.59 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.641 HG11 ' HZ2' ' A' ' 834' ' ' TRP . 67.8 t -94.68 147.3 5.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.018 -0.537 . . . . 1.79 111.372 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.487 ' N ' HG13 ' A' ' 785' ' ' VAL . 4.2 tt0 -96.06 170.82 9.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 1.3999999999999999 110.548 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.44 54.18 3.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.359 -0.382 . . . . 3.3399999999999999 110.762 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.5 p -166.75 -24.07 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.108 -0.496 . . . . 1.0900000000000001 111.036 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -53.51 122.28 9.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.081 -0.509 . . . . 0.34000000000000002 112.034 -179.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . 0.751 HD22 ' HB2' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -95.33 158.12 15.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.613 -0.884 . . . . 1.8899999999999999 108.613 178.294 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.495 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 92.7 t80 -42.54 -33.81 0.75 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.748 0.308 . . . . 0.73999999999999999 111.336 -178.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.751 ' HB2' HD22 ' A' ' 790' ' ' ASN . 1.5 m-20 -69.02 -55.01 12.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.791 -0.448 . . . . 2.0499999999999998 109.791 178.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . 0.567 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.7 OUTLIER -59.56 -29.71 68.12 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 120.974 0.416 . . . . 1.0700000000000001 110.498 179.302 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 32.4 tp -66.27 -52.95 42.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.897 -0.592 . . . . 1.55 110.217 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.679 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.3 mm -57.26 -31.84 39.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.47 -0.786 . . . . 1.0800000000000001 111.527 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.596 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.2 mtt -68.17 -53.85 22.12 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.983 -0.287 . . . . 2.21 110.539 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -52.27 -53.68 40.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.027 0.442 . . . . 1.0900000000000001 110.085 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.472 ' O ' HG12 ' A' ' 802' ' ' ILE . 94.2 mt -56.81 -53.2 45.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.668 -0.696 . . . . 1.1799999999999999 110.509 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.679 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -53.52 -28.0 28.8 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.648 -0.705 . . . . 1.2 111.285 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.07 -30.91 61.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.466 -0.334 . . . . 1.52 111.065 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.39 0.74 45.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.326 -0.397 . . . . 2.73 111.512 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.579 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 4.1 pt -122.4 -14.65 6.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.67 0.272 . . . . 1.4099999999999999 111.611 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 2.2 t -142.03 -42.05 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.773 0.321 . . . . 2.0099999999999998 111.198 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 20.8 t30 57.5 -173.78 0.08 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.152 -0.476 . . . . 3.3900000000000001 111.013 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 1.5 m -121.07 -10.23 9.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 4.5899999999999999 110.941 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -128.93 149.87 50.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.077 -0.51 . . . . 8.4399999999999995 110.939 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 6.4 m120 63.99 -82.45 0.03 OUTLIER 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.972 -0.558 . . . . 6.8600000000000003 111.224 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -71.64 145.97 48.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.952 0.406 . . . . 7.4100000000000001 111.268 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -173.6 92.06 0.09 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.961 -0.563 . . . . 7.1100000000000003 110.566 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 13.0 mm -111.88 -76.85 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.266 -0.425 . . . . 5.1699999999999999 111.294 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 811' ' ' SER . . . . . 0.434 ' HA ' ' HD3' ' A' ' 812' ' ' PRO . 2.0 p -164.76 122.15 1.12 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.298 -0.41 . . . . 2.2000000000000002 110.911 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 811' ' ' SER . 19.0 Cg_exo -65.82 147.03 84.92 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.569 2.18 . . . . 1.3799999999999999 112.08 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.417 HG21 ' N ' ' A' ' 814' ' ' THR . 14.5 mm -110.56 152.35 12.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.455 . . . . 2.4399999999999999 111.002 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 814' ' ' THR . . . . . 0.417 ' N ' HG21 ' A' ' 813' ' ' ILE . 0.7 OUTLIER -121.58 -56.18 1.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 1.73 111.162 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -92.59 118.47 31.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.247 -0.433 . . . . 3.1299999999999999 110.872 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.61 169.22 21.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.093 -0.503 . . . . 1.52 111.299 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.568 ' HB2' ' HB2' ' A' ' 852' ' ' ARG . 12.4 mmtt -107.64 172.26 6.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.969 -0.56 . . . . 1.4299999999999999 110.553 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.531 ' HB2' HD12 ' A' ' 849' ' ' LEU . 11.0 p90 -156.19 153.03 28.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.02 0.438 . . . . 1.24 111.524 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -80.04 106.65 12.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.763 -0.653 . . . . 2.0899999999999999 110.694 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.561 ' HB2' HG22 ' A' ' 826' ' ' VAL . 6.9 t0 -78.75 178.51 7.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.552 -0.749 . . . . 1.8 110.819 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -80.11 41.58 0.53 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.227 -0.442 . . . . 1.6200000000000001 111.236 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -139.76 10.87 2.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 1.6499999999999999 110.759 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 62.9 50.15 66.28 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.852 -0.69 . . . . 0.88 112.452 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -173.96 134.95 0.47 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.985 0.421 . . . . 1.8600000000000001 110.659 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -64.17 148.41 50.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.883 -0.599 . . . . 0.80000000000000004 110.778 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.561 HG22 ' HB2' ' A' ' 820' ' ' ASP . 0.2 OUTLIER -136.93 176.56 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 1.73 110.642 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.24 110.91 27.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.914 0.387 . . . . 1.21 111.138 -179.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 5.9 tt -79.69 124.07 28.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 1.52 110.869 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -69.87 -66.16 2.32 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.812 -0.709 . . . . 1.0900000000000001 112.453 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 830' ' ' SER . . . . . 0.447 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -171.02 -140.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.467 0.175 . . . . 1.8 110.617 -179.912 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.447 ' H ' ' HB3' ' A' ' 830' ' ' SER . 1.9 p30 -58.12 -18.72 27.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.779 0.323 . . . . 2.2000000000000002 111.048 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -72.23 -68.14 0.49 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.261 -0.427 . . . . 2.21 110.715 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.522 ' O ' ' HB2' ' A' ' 837' ' ' ALA . 0.7 OUTLIER -62.88 -12.27 23.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.312 -0.404 . . . . 0.72999999999999998 110.668 179.479 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.641 ' HZ2' HG11 ' A' ' 785' ' ' VAL . 2.1 t-105 -85.23 -41.8 15.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.29999999999999999 110.249 179.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . 0.493 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -68.33 -36.7 79.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.892 -0.594 . . . . 2.8500000000000001 109.489 178.984 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 64.5 t -70.62 -55.27 14.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.354 -0.839 . . . . 1.4399999999999999 109.913 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.522 ' HB2' ' O ' ' A' ' 833' ' ' ASP . . . -57.21 -24.34 53.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.953 -0.567 . . . . 1.04 110.533 179.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 28.7 mtmt -71.42 -49.63 39.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 1.3600000000000001 110.366 179.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 0.5 OUTLIER -61.26 -21.91 64.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.977 -0.556 . . . . 1.95 110.214 179.424 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.6 ttp -77.79 -36.39 50.48 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.704 -0.68 . . . . 1.0900000000000001 110.454 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 17.2 mt -66.1 -48.8 69.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 1.1799999999999999 110.629 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.81 -30.5 71.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.165 -0.47 . . . . 1.1799999999999999 111.097 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 0.7 OUTLIER -69.27 5.86 1.16 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.154 -0.476 . . . . 1.6799999999999999 110.593 179.741 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.461 ' H ' ' C ' ' A' ' 842' ' ' ALA . 9.0 m-80 -143.2 19.36 1.92 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 1.96 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 62.06 9.96 3.4 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.115 -0.493 . . . . 2.4700000000000002 111.346 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.33 174.36 10.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.499 -0.319 . . . . 2.2999999999999998 110.909 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -157.65 -32.63 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 2.46 110.84 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -80.27 147.95 30.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 1.52 110.86 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.531 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.6 OUTLIER -125.01 128.38 48.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 1.3799999999999999 111.011 -179.857 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -79.15 160.08 27.15 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.173 -0.467 . . . . 1.5600000000000001 110.978 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.697 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.1 mm -132.54 165.67 31.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.439 -0.346 . . . . 1.73 111.63 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.568 ' HB2' ' HB2' ' A' ' 817' ' ' LYS . 21.2 ttp180 -51.6 -90.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 5.6399999999999997 111.118 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 1.3 mt 50.77 24.74 1.83 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.692 0.282 . . . . 2.8900000000000001 111.634 179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 18.3 p90 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.247 -0.882 . . . . 3.3900000000000001 110.912 179.831 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.578 -0.209 . . . . 9.4199999999999999 112.578 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 56.63 28.7 14.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.829 0.347 . . . . 8.4800000000000004 111.2 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -155.17 106.71 2.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 8.6400000000000006 110.891 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -117.88 -173.62 16.27 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.717 -0.754 . . . . 4.2800000000000002 112.529 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 1.4 m -118.35 10.04 12.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.931 0.396 . . . . 3.0 110.872 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -120.72 -168.35 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 1.75 110.836 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.711 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.24 98.39 1.29 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.043 0.449 . . . . 1.3600000000000001 109.873 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.73 86.97 4.2 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.824 -0.626 . . . . 1.1899999999999999 110.678 -179.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . 0.422 HD21 ' HA ' ' A' ' 783' ' ' LEU . 0.2 OUTLIER -82.11 117.43 22.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.244 -0.889 . . . . 2.1499999999999999 110.991 -179.723 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . 0.554 HD11 ' HD2' ' A' ' 847' ' ' LYS . 0.7 OUTLIER -63.12 110.93 2.0 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.085 0.469 . . . . 1.53 110.299 179.672 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.664 HG12 ' HZ2' ' A' ' 834' ' ' TRP . 46.8 t -107.03 152.78 8.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.708 -0.678 . . . . 1.79 111.703 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.504 ' N ' HG11 ' A' ' 785' ' ' VAL . 1.0 OUTLIER -101.05 172.04 7.26 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.803 -0.635 . . . . 1.3999999999999999 110.416 179.4 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.27 53.24 2.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.962 0.411 . . . . 3.3399999999999999 110.622 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.2 p -164.19 -27.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.991 -0.55 . . . . 1.0900000000000001 111.097 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -53.23 126.01 19.54 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.092 -0.504 . . . . 0.34000000000000002 112.14 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.13 170.11 9.76 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.626 -0.879 . . . . 1.8899999999999999 108.626 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.423 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 49.8 t80 -56.15 -25.27 45.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.97 0.414 . . . . 0.73999999999999999 110.161 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' A' ' 796' ' ' MET . 26.2 t70 -72.6 -59.82 2.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.912 -0.585 . . . . 2.0499999999999998 109.933 178.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.29 -32.68 64.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.284 -0.416 . . . . 1.0700000000000001 110.125 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.31 -53.38 49.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.951 -0.568 . . . . 1.55 110.789 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.679 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 17.4 mm -56.34 -30.81 31.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.768 -0.651 . . . . 1.0800000000000001 111.689 -179.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.53 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 2.6 mtt -68.85 -56.31 8.36 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.234 -0.186 . . . . 2.21 110.964 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -52.03 -51.36 57.95 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.232 0.539 . . . . 1.0900000000000001 110.131 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.489 ' O ' HG12 ' A' ' 802' ' ' ILE . 79.5 mt -58.76 -52.78 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-N 115.505 -0.77 . . . . 1.1799999999999999 110.797 179.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.679 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t-20 -50.49 -31.73 16.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.801 -0.636 . . . . 1.2 111.536 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.54 -34.19 67.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.441 -0.345 . . . . 1.52 110.802 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.54 8.49 44.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 2.73 111.99 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.553 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 3.3 pt -129.14 -19.1 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 111.824 0.305 . . . . 1.4099999999999999 111.824 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.672 ' HG ' ' HA ' ' A' ' 812' ' ' PRO . 1.6 m -121.54 -79.23 0.61 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.577 -0.283 . . . . 2.0099999999999998 111.044 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 52.79 -164.88 0.08 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.846 0.355 . . . . 3.3900000000000001 111.178 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 3.2 t -153.72 120.32 5.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.19 -0.459 . . . . 4.5899999999999999 110.804 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -165.7 -55.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.459 . . . . 8.4399999999999995 110.95 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -95.98 -79.78 0.44 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.152 -0.477 . . . . 6.8600000000000003 111.046 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -93.18 -162.5 0.94 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.347 -0.388 . . . . 7.4100000000000001 110.849 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -66.93 -172.89 0.2 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 7.1100000000000003 110.998 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . 0.493 HG21 ' HG3' ' A' ' 812' ' ' PRO . 5.0 mt -96.88 -65.4 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.1 -0.5 . . . . 5.1699999999999999 110.867 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 8.0 t 50.54 65.88 6.23 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.013 -0.54 . . . . 2.2000000000000002 111.168 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . 0.672 ' HA ' ' HG ' ' A' ' 803' ' ' SER . 35.1 Cg_exo -61.34 144.27 98.35 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.592 2.195 . . . . 1.3799999999999999 112.32 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 1.9 mt -109.48 159.58 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 2.4399999999999999 110.8 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 9.5 p -126.42 -51.17 1.51 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.433 -0.348 . . . . 1.73 111.611 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.67 125.68 29.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.9 0.381 . . . . 3.1299999999999999 111.033 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.5 pp -146.59 160.63 10.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 1.52 111.339 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.637 ' HG3' ' HD2' ' A' ' 852' ' ' ARG . 16.5 mmtt -102.51 164.12 11.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.995 -0.548 . . . . 1.4299999999999999 110.52 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.485 ' HB2' HD12 ' A' ' 849' ' ' LEU . 12.2 p90 -145.77 153.4 40.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.948 0.404 . . . . 1.24 111.312 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . 0.434 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.6 OUTLIER -76.72 104.76 7.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.924 -0.58 . . . . 2.0899999999999999 110.751 -179.611 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.82 ' HB2' HG21 ' A' ' 826' ' ' VAL . 5.8 t70 -79.26 173.98 12.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.581 -0.736 . . . . 1.8 111.055 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . 0.484 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 6.7 pt-20 -74.1 9.42 1.6 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.14 -0.482 . . . . 1.6200000000000001 111.446 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.72 14.47 29.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.386 -0.37 . . . . 1.6499999999999999 110.802 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 59.07 46.93 93.01 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.751 -0.738 . . . . 0.88 112.376 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -174.5 136.43 0.45 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.025 0.44 . . . . 1.8600000000000001 110.546 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.464 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 91.6 m-85 -63.21 140.7 58.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.751 -0.659 . . . . 0.80000000000000004 110.915 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.82 HG21 ' HB2' ' A' ' 820' ' ' ASP . 2.4 m -130.36 -179.6 3.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.082 -0.508 . . . . 1.73 110.648 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.85 112.7 31.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.05 0.452 . . . . 1.21 111.388 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.401 HD11 ' CE1' ' A' ' 818' ' ' TYR . 0.7 OUTLIER -81.52 123.89 29.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 1.52 110.856 179.892 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -63.5 -65.74 2.91 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.806 -0.711 . . . . 1.0900000000000001 112.443 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 830' ' ' SER . . . . . 0.429 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 2.1 p -173.97 -131.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.241 -0.281 . . . . 1.8 110.241 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.429 ' H ' ' HB2' ' A' ' 830' ' ' SER . 4.8 p-10 -64.03 -14.24 52.82 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.811 0.338 . . . . 2.2000000000000002 110.743 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -69.84 0.43 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.141 -0.482 . . . . 2.21 110.697 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.69 -14.53 14.43 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.149 -0.478 . . . . 0.72999999999999998 110.395 179.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.664 ' HZ2' HG12 ' A' ' 785' ' ' VAL . 1.3 t-105 -81.18 -43.54 19.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.127 -0.488 . . . . 0.29999999999999999 110.094 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . 0.73 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -67.3 -35.93 80.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.025 -0.534 . . . . 2.8500000000000001 109.78 178.927 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . 0.468 HG21 ' ND2' ' A' ' 835' ' ' ASN . 21.8 t -71.22 -55.74 12.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.398 -0.819 . . . . 1.4399999999999999 110.274 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.75 -24.15 55.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.005 -0.543 . . . . 1.04 110.591 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.73 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 31.5 mtmt -71.95 -42.26 66.8 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.163 -0.471 . . . . 1.3600000000000001 110.293 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -65.45 -27.63 68.65 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.103 -0.498 . . . . 1.95 110.014 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 840' ' ' MET . . . . . 0.484 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 12.4 ttp -72.27 -35.13 68.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.743 -0.662 . . . . 1.0900000000000001 110.343 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 846' ' ' GLU . 50.4 mt -70.47 -51.97 25.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.816 -0.629 . . . . 1.1799999999999999 110.811 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.442 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -75.69 -0.63 21.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 1.1799999999999999 111.359 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -65.85 -0.75 2.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.992 0.425 . . . . 1.6799999999999999 110.299 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.442 ' H ' ' C ' ' A' ' 842' ' ' ALA . 69.8 m-80 -150.67 -71.39 0.17 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.852 -0.613 . . . . 1.96 110.507 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.38 27.18 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.885 -0.598 . . . . 2.4700000000000002 111.0 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 841' ' ' LEU . 4.5 mt-10 -87.61 156.29 19.56 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.87 0.367 . . . . 2.2999999999999998 111.038 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . 0.554 ' HD2' HD11 ' A' ' 784' ' ' LEU . 2.9 pttt -145.85 -29.07 0.42 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.039 -0.528 . . . . 2.46 110.956 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.433 ' HE1' HD12 ' A' ' 784' ' ' LEU . 36.6 m-85 -79.8 157.29 27.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.183 -0.462 . . . . 1.52 110.922 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.5 OUTLIER -141.24 126.48 18.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 1.3799999999999999 110.852 179.815 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.434 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 13.9 m120 -77.47 161.2 28.13 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.362 -0.381 . . . . 1.5600000000000001 111.171 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.711 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.6 OUTLIER -131.29 170.53 19.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 CA-C-N 116.346 -0.388 . . . . 1.73 111.527 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.637 ' HD2' ' HG3' ' A' ' 817' ' ' LYS . 45.7 ttt-85 -53.35 -87.23 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.235 -0.439 . . . . 5.6399999999999997 110.915 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 55.46 18.07 2.49 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.201 -0.454 . . . . 2.8900000000000001 111.455 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . 0.457 ' CD1' ' HG3' ' A' ' 852' ' ' ARG . 12.1 p90 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.211 -0.9 . . . . 3.3900000000000001 110.903 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 112.494 -0.242 . . . . 9.4199999999999999 112.494 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -81.23 110.96 17.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.735 0.302 . . . . 8.4800000000000004 111.122 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 2.3 mmm 56.82 -160.92 0.21 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.104 -0.498 . . . . 8.6400000000000006 111.04 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 122.94 -5.27 9.69 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.866 -0.683 . . . . 4.2800000000000002 112.47 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -105.74 -41.98 5.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.823 0.344 . . . . 3.0 110.908 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.454 HG23 ' ND2' ' A' ' 850' ' ' ASN . 0.1 OUTLIER -132.44 -162.51 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.135 -0.484 . . . . 1.75 110.973 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.583 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.68 91.11 1.28 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.05 0.452 . . . . 1.3600000000000001 110.113 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.573 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -98.33 92.89 5.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 1.1899999999999999 111.106 -179.414 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.64 157.77 17.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.688 -0.687 . . . . 2.1499999999999999 110.746 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.75 112.78 23.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.417 -0.356 . . . . 1.53 110.381 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.583 HG11 ' N ' ' A' ' 786' ' ' GLU . 23.5 t -107.6 153.63 8.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.035 -0.53 . . . . 1.79 111.515 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.583 ' N ' HG11 ' A' ' 785' ' ' VAL . 0.2 OUTLIER -104.82 175.37 5.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.883 -0.598 . . . . 1.3999999999999999 110.453 179.509 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -90.0 55.63 3.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.991 0.424 . . . . 3.3399999999999999 110.734 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.5 p -168.07 -26.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.052 -0.522 . . . . 1.0900000000000001 111.156 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -52.42 125.42 16.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.34000000000000002 111.767 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.68 169.78 10.23 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.808 -0.812 . . . . 1.8899999999999999 108.808 178.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.428 ' O ' HG12 ' A' ' 795' ' ' ILE . 10.1 t80 -55.62 -25.02 36.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.984 0.421 . . . . 0.73999999999999999 109.912 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.544 ' O ' ' HG3' ' A' ' 796' ' ' MET . 4.6 m-20 -73.22 -61.18 1.91 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.896 -0.593 . . . . 2.0499999999999998 109.679 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.94 -32.05 60.97 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 116.229 -0.441 . . . . 1.0700000000000001 110.321 179.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.452 HD22 ' CE2' ' A' ' 834' ' ' TRP . 23.2 tp -64.42 -52.78 56.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.814 -0.63 . . . . 1.55 110.506 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.649 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 21.2 mm -59.55 -30.83 45.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.697 -0.683 . . . . 1.0800000000000001 111.571 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.544 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 3.2 mtt -68.56 -53.76 20.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.61 0.243 . . . . 2.21 110.736 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.09 -49.57 66.17 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.082 0.467 . . . . 1.0900000000000001 110.285 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.437 HG23 HG12 ' A' ' 802' ' ' ILE . 56.5 mt -60.83 -52.84 56.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.623 -0.717 . . . . 1.1799999999999999 110.546 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.649 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -51.81 -23.71 5.07 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.604 -0.725 . . . . 1.2 111.548 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.46 -33.8 31.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.384 -0.371 . . . . 1.52 110.676 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -94.81 4.17 54.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.061 -0.518 . . . . 2.73 111.454 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.561 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.1 pt -124.6 -35.04 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 111.725 0.269 . . . . 1.4099999999999999 111.725 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.531 ' N ' HG13 ' A' ' 802' ' ' ILE . 23.0 p -136.45 81.39 1.88 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.946 0.403 . . . . 2.0099999999999998 111.071 -179.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -87.69 122.98 32.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.917 -0.583 . . . . 3.3900000000000001 110.73 179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 805' ' ' THR . . . . . 0.521 HG23 ' H ' ' A' ' 806' ' ' HIS . 0.2 OUTLIER 62.98 169.45 0.14 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.225 -0.443 . . . . 4.5899999999999999 111.252 -179.748 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . 0.521 ' H ' HG23 ' A' ' 805' ' ' THR . 2.5 t-80 -80.5 -63.55 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 8.4399999999999995 110.681 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 3.5 t30 53.82 80.83 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 6.8600000000000003 110.919 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 31.9 m120 61.58 -85.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.035 -0.53 . . . . 7.4100000000000001 111.074 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -147.33 144.56 28.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.879 0.371 . . . . 7.1100000000000003 111.041 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -138.1 178.35 4.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.034 -0.53 . . . . 5.1699999999999999 111.001 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 1.5 m -137.63 88.16 16.71 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.33 -0.396 . . . . 2.2000000000000002 111.234 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.22 -174.45 1.2 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.528 2.152 . . . . 1.3799999999999999 112.02 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 2.8 pt -147.79 139.07 17.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.309 -0.405 . . . . 2.4399999999999999 111.326 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 72.0 p -114.18 -46.32 3.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 1.73 111.078 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -99.1 127.28 45.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 3.1299999999999999 110.861 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.1 pp -153.82 171.51 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.173 -0.467 . . . . 1.52 111.229 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.64 ' HG3' ' HD3' ' A' ' 852' ' ' ARG . 13.0 mmtt -101.49 175.07 5.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 1.4299999999999999 110.821 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.642 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 27.5 p90 -145.6 156.75 43.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.225 -0.443 . . . . 1.24 111.08 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . 0.476 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.8 OUTLIER -86.93 106.49 17.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.228 0.537 . . . . 2.0899999999999999 110.59 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -79.4 177.76 8.61 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.426 -0.806 . . . . 1.8 110.886 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . 0.491 ' HG2' ' HG3' ' A' ' 840' ' ' MET . 0.2 OUTLIER -80.69 13.2 2.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.121 -0.49 . . . . 1.6200000000000001 111.088 -179.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -99.75 -11.82 20.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 1.6499999999999999 110.743 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 94.39 11.36 57.28 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.705 -0.759 . . . . 0.88 112.618 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -128.5 -153.49 0.57 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.997 0.427 . . . . 1.8600000000000001 110.612 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.465 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 63.0 m-85 -133.26 134.94 44.58 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.918 -0.583 . . . . 0.80000000000000004 111.195 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.642 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 1.5 t -111.32 173.18 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 116.052 -0.522 . . . . 1.73 110.946 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 6.1 t -99.45 107.06 19.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.797 0.332 . . . . 1.21 111.074 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 7.5 tp -79.76 104.92 10.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 1.52 110.672 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.11 -63.66 3.68 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.831 -0.7 . . . . 1.0900000000000001 112.712 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 830' ' ' SER . . . . . 0.464 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -166.64 -142.45 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.465 0.174 . . . . 1.8 110.571 -179.795 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.464 ' H ' ' HB3' ' A' ' 830' ' ' SER . 4.6 t0 -59.66 -14.1 12.45 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.739 0.304 . . . . 2.2000000000000002 110.925 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -73.8 -70.88 0.35 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.289 -0.414 . . . . 2.21 110.733 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.575 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 9.7 m-20 -63.31 -11.91 25.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.72999999999999998 110.357 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.483 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.5 t-105 -83.1 -39.69 20.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.18 -0.464 . . . . 0.29999999999999999 109.898 179.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . 0.684 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -69.9 -36.36 75.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.893 -0.594 . . . . 2.8500000000000001 109.936 178.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.01 -54.54 16.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.419 -0.81 . . . . 1.4399999999999999 110.296 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.575 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -58.39 -24.85 61.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.099 -0.501 . . . . 1.04 110.462 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.684 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.0 mtmt -69.77 -43.46 72.16 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.101 -0.5 . . . . 1.3600000000000001 110.367 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -64.41 -26.21 68.36 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 1.95 110.031 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 840' ' ' MET . . . . . 0.491 ' HG3' ' HG2' ' A' ' 821' ' ' GLU . 7.6 ttp -72.92 -36.5 67.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.667 -0.697 . . . . 1.0900000000000001 110.155 179.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.631 HD11 HD22 ' A' ' 849' ' ' LEU . 3.2 mt -68.59 -44.28 74.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.585 . . . . 1.1799999999999999 110.773 179.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.475 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.46 -23.51 66.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 1.1799999999999999 111.179 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.8 3.81 1.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 1.6799999999999999 110.591 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.475 ' H ' ' C ' ' A' ' 842' ' ' ALA . 38.6 m-80 -151.31 16.69 0.73 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.968 -0.56 . . . . 1.96 110.692 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 24.0 t30 58.59 19.68 6.91 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.01 -0.541 . . . . 2.4700000000000002 111.102 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.16 161.06 29.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 2.2999999999999998 111.024 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -152.54 10.25 0.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 2.46 110.696 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.573 ' HB3' HG22 ' A' ' 782' ' ' THR . 74.6 m-85 -112.97 125.91 54.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.957 -0.565 . . . . 1.52 110.765 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.631 HD22 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -122.06 119.08 30.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 1.3799999999999999 111.002 -179.688 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.476 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 6.5 m120 -82.17 174.68 10.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 1.5600000000000001 111.178 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.583 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.6 mm -133.29 165.25 32.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.165 -0.471 . . . . 1.73 111.167 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.64 ' HD3' ' HG3' ' A' ' 817' ' ' LYS . 10.3 ttp180 -47.92 -89.27 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.476 -0.329 . . . . 5.6399999999999997 111.143 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 49.79 24.4 1.25 Allowed 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.287 -0.415 . . . . 2.8900000000000001 111.47 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . 0.496 ' CD1' ' HG3' ' A' ' 852' ' ' ARG . 14.9 p90 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.302 -0.856 . . . . 3.3900000000000001 110.947 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.175 0 N-CA-C 112.479 -0.248 . . . . 9.4199999999999999 112.479 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -130.56 97.6 4.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.853 0.359 . . . . 8.4800000000000004 110.985 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.78 -32.15 2.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 8.6400000000000006 110.887 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 153.89 167.45 16.1 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.845 -0.693 . . . . 4.2800000000000002 112.545 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 18.3 t -112.63 -39.75 4.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.671 0.272 . . . . 3.0 110.968 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.448 HG21 HD21 ' A' ' 850' ' ' ASN . 0.0 OUTLIER -125.34 -164.74 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.264 -0.425 . . . . 1.75 110.978 -179.964 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.655 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -144.21 84.15 1.75 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.254 -0.43 . . . . 1.3600000000000001 109.971 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.3 OUTLIER -98.5 102.64 14.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 1.1899999999999999 111.602 -179.258 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.54 -164.87 1.19 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.009 -0.541 . . . . 2.1499999999999999 110.342 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.04 108.83 15.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.012 0.434 . . . . 1.53 110.151 179.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.462 HG11 ' CE3' ' A' ' 789' ' ' TRP . 90.3 t -101.88 147.11 9.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.664 -0.698 . . . . 1.79 111.155 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -103.98 168.84 8.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.257 -0.429 . . . . 1.3999999999999999 110.953 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.82 56.53 3.93 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.193 0.52 . . . . 3.3399999999999999 110.488 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . 0.404 ' O ' HG21 ' A' ' 788' ' ' VAL . 1.7 p -164.32 -27.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.515 -0.766 . . . . 1.0900000000000001 110.49 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . 0.462 ' CE3' HG11 ' A' ' 785' ' ' VAL . 30.3 m0 -50.52 124.25 10.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.498 -0.774 . . . . 0.34000000000000002 111.897 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . 0.723 HD22 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -93.43 162.62 13.91 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.916 -0.772 . . . . 1.8899999999999999 108.916 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -44.04 -30.18 0.7 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.824 0.345 . . . . 0.73999999999999999 111.395 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.723 ' HB3' HD22 ' A' ' 790' ' ' ASN . 13.1 t0 -76.69 -59.01 2.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.233 -0.44 . . . . 2.0499999999999998 110.143 179.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . 0.593 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 1.4 m-20 -53.12 -21.69 5.21 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.553 0.692 . . . . 1.0700000000000001 109.271 178.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.684 HD11 HD11 ' A' ' 798' ' ' ILE . 1.3 tm? -74.19 -75.58 0.15 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.766 -1.106 . . . . 1.55 109.988 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.615 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 23.4 mm -46.44 -32.38 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.032 -0.985 . . . . 1.0800000000000001 111.98 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.631 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 26.1 mtm -69.93 -42.23 73.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.711 0.291 . . . . 2.21 110.836 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -63.73 -47.68 80.09 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.012 0.434 . . . . 1.0900000000000001 110.101 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.684 HD11 HD11 ' A' ' 794' ' ' LEU . 31.2 mt -62.74 -50.23 80.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.711 -0.677 . . . . 1.1799999999999999 110.176 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.616 HD22 ' H ' ' A' ' 813' ' ' ILE . 1.2 t-20 -52.19 -32.63 37.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.6 -0.727 . . . . 1.2 111.242 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 800' ' ' SER . . . . . 0.508 ' O ' ' HB2' ' A' ' 804' ' ' ASN . 0.2 OUTLIER -72.87 -32.69 65.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 1.52 110.79 179.838 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . 0.448 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 4.4 mmtt -88.05 -5.06 58.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.093 -0.503 . . . . 2.73 111.374 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.723 HD13 HG12 ' A' ' 813' ' ' ILE . 1.3 pp -111.79 -21.65 5.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.498 -0.319 . . . . 1.4099999999999999 111.423 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.662 ' HB2' HD11 ' A' ' 802' ' ' ILE . 0.1 OUTLIER -157.07 91.28 1.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.342 -0.39 . . . . 2.0099999999999998 111.085 -179.82 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . 0.508 ' HB2' ' O ' ' A' ' 800' ' ' SER . 5.0 t-20 -127.47 -40.7 1.76 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.178 -0.464 . . . . 3.3900000000000001 110.843 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 44.1 p -132.08 -168.89 2.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 4.5899999999999999 110.9 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -67.86 89.42 0.28 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.289 -0.414 . . . . 8.4399999999999995 110.72 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . 0.451 ' HB3' ' H ' ' A' ' 808' ' ' ASN . 8.0 m120 -112.59 -163.0 0.82 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.077 -0.511 . . . . 6.8600000000000003 110.789 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . 0.451 ' H ' ' HB3' ' A' ' 807' ' ' ASN . 3.2 t30 -66.1 -17.9 65.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.29 -0.414 . . . . 7.4100000000000001 111.121 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -129.91 175.93 8.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 7.1100000000000003 111.056 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -137.29 -41.96 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.174 -0.466 . . . . 5.1699999999999999 111.1 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 1.4 p -80.5 133.05 56.89 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 2.2000000000000002 110.775 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.24 -169.42 0.35 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.584 2.189 . . . . 1.3799999999999999 112.392 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.723 HG12 HD13 ' A' ' 802' ' ' ILE . 11.6 pt -135.59 -178.22 2.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 2.4399999999999999 111.084 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 8.9 p -142.73 -66.32 0.39 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.093 -0.503 . . . . 1.73 111.097 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.03 129.68 34.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.148 -0.478 . . . . 3.1299999999999999 110.66 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.3 pp -146.05 161.53 11.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.065 0.459 . . . . 1.52 111.495 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.859 ' HB2' ' HB3' ' A' ' 852' ' ' ARG . 17.5 mmtt -102.31 160.03 14.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.746 -0.661 . . . . 1.4299999999999999 110.496 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.488 ' HB2' HD11 ' A' ' 849' ' ' LEU . 11.0 p90 -145.31 156.49 43.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.973 0.416 . . . . 1.24 111.307 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -78.59 107.01 10.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.832 -0.622 . . . . 2.0899999999999999 110.738 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.707 ' HB2' HG23 ' A' ' 826' ' ' VAL . 2.7 t0 -78.27 176.41 9.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.631 -0.713 . . . . 1.8 110.578 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -76.04 4.76 7.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.438 . . . . 1.6200000000000001 111.409 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -102.65 16.01 27.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.408 -0.36 . . . . 1.6499999999999999 110.833 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 57.73 50.56 64.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.822 -0.704 . . . . 0.88 112.358 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -173.1 132.89 0.51 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.794 0.331 . . . . 1.8600000000000001 110.635 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.464 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 71.6 m-85 -61.03 142.55 56.54 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.097 -0.501 . . . . 0.80000000000000004 110.682 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.707 HG23 ' HB2' ' A' ' 820' ' ' ASP . 2.4 m -134.66 179.39 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.297 -0.41 . . . . 1.73 111.037 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -99.14 113.11 33.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.969 0.414 . . . . 1.21 111.371 -179.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.24 120.81 24.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.825 -0.625 . . . . 1.52 110.835 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.12 -68.27 1.71 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.844 -0.693 . . . . 1.0900000000000001 112.606 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -170.8 -144.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.485 -0.191 . . . . 1.8 110.485 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -53.77 -25.03 17.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.74 0.305 . . . . 2.2000000000000002 111.081 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -66.59 0.53 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.233 -0.439 . . . . 2.21 110.656 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.514 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 1.6 m-20 -64.22 -12.14 37.89 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.277 -0.42 . . . . 0.72999999999999998 110.348 179.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.439 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 3.6 t-105 -81.88 -40.02 23.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.29999999999999999 109.808 178.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . 0.664 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 11.6 m-80 -71.02 -32.04 68.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 2.8500000000000001 109.883 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 39.7 t -75.34 -53.77 15.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.715 -0.675 . . . . 1.4399999999999999 109.818 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -56.33 -28.11 57.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.996 -0.547 . . . . 1.04 110.315 179.003 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.664 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.1 mtmt -71.86 -48.41 46.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.854 -0.612 . . . . 1.3600000000000001 110.267 179.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.12 -22.49 66.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.944 -0.571 . . . . 1.95 110.104 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 1.2 ttp -77.54 -35.16 53.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.811 -0.631 . . . . 1.0900000000000001 110.266 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.401 HD23 ' HB3' ' A' ' 846' ' ' GLU . 10.2 mt -66.33 -48.86 68.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.917 -0.583 . . . . 1.1799999999999999 110.805 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.465 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.51 -29.69 70.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.414 . . . . 1.1799999999999999 111.017 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -70.63 8.59 0.82 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.984 -0.553 . . . . 1.6799999999999999 110.792 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.465 ' H ' ' C ' ' A' ' 842' ' ' ALA . 40.4 m-80 -148.55 19.63 1.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 1.96 111.005 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 62.77 10.84 4.49 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.206 -0.452 . . . . 2.4700000000000002 111.064 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.401 ' HB3' HD23 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -86.38 147.1 26.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 2.2999999999999998 110.859 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.45 -18.91 1.45 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 2.46 110.931 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -87.96 147.02 25.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.278 -0.419 . . . . 1.52 110.764 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.488 HD11 ' HB2' ' A' ' 818' ' ' TYR . 0.4 OUTLIER -124.03 133.49 53.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.905 0.384 . . . . 1.3799999999999999 111.321 -179.498 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.448 HD21 HG21 ' A' ' 780' ' ' ILE . 8.7 m120 -92.48 157.75 16.4 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.989 -0.55 . . . . 1.5600000000000001 110.747 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.655 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -122.92 167.39 16.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.465 -0.334 . . . . 1.73 111.82 -179.479 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.859 ' HB3' ' HB2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -47.84 -73.25 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.886 -0.597 . . . . 5.6399999999999997 111.515 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 59.94 35.93 21.67 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.044 -0.525 . . . . 2.8900000000000001 110.659 -179.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.171 -0.918 . . . . 3.3900000000000001 110.799 179.922 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.098 0 N-CA-C 112.371 -0.292 . . . . 9.4199999999999999 112.371 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -94.3 -49.29 5.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.764 0.316 . . . . 8.4800000000000004 111.131 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.96 103.34 15.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.223 -0.444 . . . . 8.6400000000000006 110.715 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 173.52 131.34 1.38 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.861 -0.685 . . . . 4.2800000000000002 112.41 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 779' ' ' SER . . . . . 0.462 ' O ' ' HB3' ' A' ' 853' ' ' LEU . 0.4 OUTLIER -156.15 -29.1 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.807 0.337 . . . . 3.0 110.871 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -139.49 -174.74 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.238 -0.437 . . . . 1.75 110.877 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.535 ' HB3' ' CD1' ' A' ' 851' ' ' ILE . 0.0 OUTLIER -150.83 89.72 1.56 Allowed 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.594 -0.521 . . . . 1.3600000000000001 109.594 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.1 OUTLIER -97.99 110.6 23.15 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.816 -0.629 . . . . 1.1899999999999999 111.473 -179.013 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . 0.513 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -110.6 -167.67 1.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.801 -0.636 . . . . 2.1499999999999999 110.606 179.765 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.57 109.24 18.67 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.027 -0.533 . . . . 1.53 110.194 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 27.9 m -105.79 172.73 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 1.79 111.462 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -129.4 158.43 39.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.943 -0.571 . . . . 1.3999999999999999 110.875 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -9.56 51.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 3.3399999999999999 110.959 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.8 p -95.05 -24.97 4.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.884 -0.598 . . . . 1.0900000000000001 110.762 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 27.0 m0 -58.41 124.72 20.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.738 -0.665 . . . . 0.34000000000000002 111.854 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . 0.851 HD22 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -98.06 161.35 13.76 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.916 -0.772 . . . . 1.8899999999999999 108.916 178.394 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.46 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 53.5 t80 -44.36 -33.13 1.54 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.829 0.347 . . . . 0.73999999999999999 111.138 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.851 ' HB3' HD22 ' A' ' 790' ' ' ASN . 35.7 t70 -69.52 -55.21 10.84 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.669 -0.493 . . . . 2.0499999999999998 109.669 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . 0.59 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.6 OUTLIER -58.74 -23.65 60.26 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.167 0.508 . . . . 1.0700000000000001 110.31 179.124 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.473 HD13 ' CZ2' ' A' ' 834' ' ' TRP . 34.5 tp -74.05 -54.35 8.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.62 -0.718 . . . . 1.55 110.367 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.665 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 32.0 mm -57.41 -31.45 38.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.593 -0.73 . . . . 1.0800000000000001 111.74 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.652 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 33.4 mtm -68.14 -50.23 56.0 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.965 -0.294 . . . . 2.21 110.417 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.72 -52.64 61.83 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.026 0.441 . . . . 1.0900000000000001 109.99 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.584 HG12 HD12 ' A' ' 851' ' ' ILE . 68.0 mt -58.68 -51.4 72.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.731 -0.668 . . . . 1.1799999999999999 110.61 179.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.665 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.7 OUTLIER -57.15 -24.39 53.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.61 -0.723 . . . . 1.2 111.199 -179.754 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 34.6 m -79.8 -26.72 40.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.108 -0.496 . . . . 1.52 110.644 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . 0.517 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -98.91 -3.97 33.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.092 -0.503 . . . . 2.73 111.19 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.583 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.2 pt -116.69 -25.52 3.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.76 0.314 . . . . 1.4099999999999999 111.437 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.492 ' N ' HG13 ' A' ' 802' ' ' ILE . 0.3 OUTLIER -151.54 80.94 1.29 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 2.0099999999999998 111.134 -179.844 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -170.92 -21.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.259 -0.428 . . . . 3.3900000000000001 111.204 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 2.7 t -156.39 -17.06 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.359 -0.382 . . . . 4.5899999999999999 111.355 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -106.21 134.61 49.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.33 -0.395 . . . . 8.4399999999999995 110.953 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -108.9 65.64 0.62 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.279 -0.419 . . . . 6.8600000000000003 110.935 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -108.72 0.11 20.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 7.4100000000000001 110.797 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -144.51 -168.25 2.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.963 -0.562 . . . . 7.1100000000000003 110.605 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 6.8 mt -111.02 -55.43 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.434 -0.348 . . . . 5.1699999999999999 111.296 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 32.6 m -129.63 151.47 78.1 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.351 -0.386 . . . . 2.2000000000000002 110.969 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . 0.432 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 46.3 Cg_exo -56.87 175.35 0.31 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.628 2.219 . . . . 1.3799999999999999 112.161 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 1.4 pp -138.77 158.16 30.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.296 -0.411 . . . . 2.4399999999999999 111.277 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 29.7 p -115.68 -46.35 2.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.273 -0.422 . . . . 1.73 111.182 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . 0.441 ' O ' HG21 ' A' ' 816' ' ' ILE . 2.3 mmtt -80.73 139.61 36.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 3.1299999999999999 110.706 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . 0.441 HG21 ' O ' ' A' ' 815' ' ' LYS . 0.4 OUTLIER -153.26 175.4 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 121.022 0.439 . . . . 1.52 111.452 -179.848 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.632 ' N ' ' HG3' ' A' ' 852' ' ' ARG . 16.2 mmtt -130.88 126.54 36.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.798 -0.637 . . . . 1.4299999999999999 110.188 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.589 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 9.1 p90 -96.74 165.2 12.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.808 0.337 . . . . 1.24 111.057 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . 0.533 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 5.6 tp60 -103.28 113.31 26.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.099 0.475 . . . . 2.0899999999999999 110.576 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -78.96 170.3 16.9 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.556 -0.747 . . . . 1.8 110.941 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.7 9.8 3.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.128 -0.487 . . . . 1.6200000000000001 111.251 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -105.72 6.61 32.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 1.6499999999999999 111.024 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 67.28 57.31 9.5 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.791 -0.719 . . . . 0.88 112.469 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -170.29 131.34 0.96 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.946 0.403 . . . . 1.8600000000000001 110.662 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -72.21 131.21 42.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.882 -0.599 . . . . 0.80000000000000004 110.942 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.589 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -115.14 166.58 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 115.787 -0.642 . . . . 1.73 111.086 -179.64 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . 0.445 HG23 ' HE2' ' A' ' 817' ' ' LYS . 0.2 OUTLIER -99.24 103.49 14.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 1.21 110.618 179.697 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.0 tt -79.5 119.01 21.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.103 -0.499 . . . . 1.52 110.916 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -65.58 -66.46 2.42 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.875 -0.678 . . . . 1.0900000000000001 112.775 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 830' ' ' SER . . . . . 0.49 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 2.5 m -167.54 -135.16 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 110.463 -0.199 . . . . 1.8 110.463 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.49 ' H ' ' HB3' ' A' ' 830' ' ' SER . 1.0 OUTLIER -57.81 -22.46 47.56 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.801 0.334 . . . . 2.2000000000000002 110.941 179.797 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -68.1 -70.05 0.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 2.21 110.877 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.13 -13.91 20.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.35 -0.386 . . . . 0.72999999999999998 110.511 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.502 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 0.4 OUTLIER -80.06 -44.96 19.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.969 -0.56 . . . . 0.29999999999999999 109.941 179.249 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . 0.682 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 18.7 m-80 -68.11 -30.19 69.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.08 -0.509 . . . . 2.8500000000000001 110.061 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 65.1 t -76.39 -56.02 9.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.735 -0.666 . . . . 1.4399999999999999 110.325 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.28 -27.59 64.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.006 -0.543 . . . . 1.04 110.611 179.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.682 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 25.1 mtmt -69.21 -45.27 70.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.183 -0.462 . . . . 1.3600000000000001 110.171 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.99 -26.17 65.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.079 -0.509 . . . . 1.95 110.082 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 19.8 ttp -74.54 -35.32 63.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.632 -0.713 . . . . 1.0900000000000001 110.319 179.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.617 HD22 ' HB3' ' A' ' 846' ' ' GLU . 18.7 mt -66.67 -55.94 12.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.056 -0.52 . . . . 1.1799999999999999 110.646 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.479 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -61.44 -20.3 62.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.038 -0.528 . . . . 1.1799999999999999 111.235 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.13 2.21 1.66 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 1.6799999999999999 110.403 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.479 ' H ' ' C ' ' A' ' 842' ' ' ALA . 54.0 m-80 -153.7 23.15 0.52 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.902 -0.59 . . . . 1.96 110.769 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.9 t30 59.24 21.59 9.77 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.076 -0.511 . . . . 2.4700000000000002 111.036 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.617 ' HB3' HD22 ' A' ' 841' ' ' LEU . 1.5 mt-10 -82.85 142.09 31.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 2.2999999999999998 110.867 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 4.05 4.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 2.46 111.044 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.513 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 4.5 m-85 -104.0 126.17 50.92 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.24 -0.436 . . . . 1.52 110.94 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.5 OUTLIER -119.06 127.66 53.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 1.3799999999999999 111.116 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.533 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 17.2 m-20 -86.0 156.21 20.54 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.962 -0.563 . . . . 1.5600000000000001 110.721 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.584 HD12 HG12 ' A' ' 798' ' ' ILE . 1.7 mt -130.33 170.23 19.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.753 0.311 . . . . 1.73 111.835 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.632 ' HG3' ' N ' ' A' ' 817' ' ' LYS . 0.5 OUTLIER -37.66 -83.44 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.9 -0.591 . . . . 5.6399999999999997 112.088 -179.422 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . 0.462 ' HB3' ' O ' ' A' ' 779' ' ' SER . 0.2 OUTLIER 55.38 36.3 26.81 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.277 -0.42 . . . . 2.8900000000000001 110.646 -179.433 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . 0.63 ' HD2' ' HG2' ' A' ' 852' ' ' ARG . 13.8 m-85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.162 -0.923 . . . . 3.3900000000000001 110.916 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.421 -0.272 . . . . 9.4199999999999999 112.421 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 56.9 89.05 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.878 0.371 . . . . 8.4800000000000004 111.245 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.21 76.45 1.58 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.172 -0.467 . . . . 8.6400000000000006 110.881 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 117.84 157.34 10.61 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.813 -0.708 . . . . 4.2800000000000002 112.527 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 779' ' ' SER . . . . . 0.506 ' H ' HD11 ' A' ' 853' ' ' LEU . 0.1 OUTLIER -148.93 -173.99 4.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.805 0.336 . . . . 3.0 111.031 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER -120.72 -176.35 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.084 -0.507 . . . . 1.75 110.811 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.775 ' HB3' HD13 ' A' ' 851' ' ' ILE . 0.4 OUTLIER -151.82 93.92 1.91 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.497 -0.557 . . . . 1.3600000000000001 109.497 179.55 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.61 HG21 ' HB3' ' A' ' 848' ' ' PHE . 0.2 OUTLIER -97.89 99.92 11.26 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.608 -0.724 . . . . 1.1899999999999999 111.233 -178.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -106.28 140.9 38.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.602 -0.726 . . . . 2.1499999999999999 110.572 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.47 113.77 12.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.076 0.465 . . . . 1.53 110.489 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.414 HG13 ' HH2' ' A' ' 834' ' ' TRP . 32.7 m -106.1 -163.92 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.516 -0.766 . . . . 1.79 111.152 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -150.06 169.14 21.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.219 -0.446 . . . . 1.3999999999999999 111.132 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . 0.546 ' HB2' ' HZ2' ' A' ' 787' ' ' LYS . 0.0 OUTLIER -79.33 -10.34 59.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 3.3399999999999999 110.917 -179.788 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.6 p -97.64 -28.02 3.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.921 -0.581 . . . . 1.0900000000000001 110.719 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 21.2 m0 -53.36 119.06 4.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.759 -0.655 . . . . 0.34000000000000002 111.565 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.05 168.22 16.12 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.215 -0.661 . . . . 1.8899999999999999 109.215 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -53.4 -25.51 16.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.931 0.396 . . . . 0.73999999999999999 110.199 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.629 ' O ' ' HG3' ' A' ' 796' ' ' MET . 47.1 m-20 -79.97 -57.46 3.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.952 -0.567 . . . . 2.0499999999999998 109.688 178.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.01 -21.72 4.82 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.036 -0.727 . . . . 1.0700000000000001 109.036 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.696 HD12 HD12 ' A' ' 798' ' ' ILE . 1.3 tm? -75.35 -76.44 0.15 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.827 -1.079 . . . . 1.55 110.208 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.627 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 16.3 mm -45.52 -35.67 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.162 -0.926 . . . . 1.0800000000000001 112.072 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.629 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 20.7 mtt -67.91 -48.98 64.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.563 0.22 . . . . 2.21 110.715 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -56.55 -52.81 63.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.112 0.482 . . . . 1.0900000000000001 109.965 179.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.696 HD12 HD12 ' A' ' 794' ' ' LEU . 76.4 mt -56.93 -52.71 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.553 -0.749 . . . . 1.1799999999999999 110.527 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.762 ' HA ' HG12 ' A' ' 802' ' ' ILE . 1.6 t-20 -53.2 -34.29 56.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.412 -0.813 . . . . 1.2 111.372 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 13.3 t -69.18 -30.47 68.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.337 -0.392 . . . . 1.52 110.941 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -88.38 -18.42 28.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 2.73 111.42 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.762 HG12 ' HA ' ' A' ' 799' ' ' ASN . 0.9 OUTLIER -94.8 -23.84 5.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.716 0.293 . . . . 1.4099999999999999 111.355 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.467 ' N ' HG13 ' A' ' 802' ' ' ILE . 94.9 p -135.83 76.2 1.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.345 -0.389 . . . . 2.0099999999999998 110.9 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -65.88 160.24 23.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 3.3900000000000001 110.772 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 5.4 t -76.75 157.18 31.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.261 -0.427 . . . . 4.5899999999999999 111.207 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 59.08 -167.6 0.16 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.034 -0.53 . . . . 8.4399999999999995 111.165 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . 0.48 ' HB3' ' H ' ' A' ' 808' ' ' ASN . 56.3 t30 59.04 -95.06 0.05 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.053 -0.521 . . . . 6.8600000000000003 111.059 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . 0.48 ' H ' ' HB3' ' A' ' 807' ' ' ASN . 0.7 OUTLIER -130.35 94.64 3.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.779 0.323 . . . . 7.4100000000000001 110.979 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.84 89.57 1.85 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 7.1100000000000003 110.944 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 5.1 pt -84.62 165.97 2.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.137 -0.483 . . . . 5.1699999999999999 111.267 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 6.9 t -68.23 120.8 77.2 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.109 -0.496 . . . . 2.2000000000000002 111.039 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . 0.469 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 31.2 Cg_exo -59.68 162.25 15.95 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.542 2.161 . . . . 1.3799999999999999 112.456 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 14.3 mm -115.7 153.91 17.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.123 -0.49 . . . . 2.4399999999999999 110.904 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -124.08 -68.67 0.85 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.437 -0.347 . . . . 1.73 111.462 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.78 129.77 34.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.309 -0.405 . . . . 3.1299999999999999 110.794 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.5 pp -144.75 -178.22 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.211 -0.45 . . . . 1.52 111.409 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.601 ' HB2' ' HB2' ' A' ' 852' ' ' ARG . 15.6 mmtt -121.79 149.92 42.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.983 -0.553 . . . . 1.4299999999999999 110.488 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.692 ' HB2' HD12 ' A' ' 849' ' ' LEU . 0.9 OUTLIER -130.98 165.05 24.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.364 . . . . 1.24 111.299 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.05 109.13 21.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.947 -0.57 . . . . 2.0899999999999999 111.086 -179.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -79.12 167.31 21.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.566 -0.743 . . . . 1.8 110.53 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -70.06 -0.0 6.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.351 -0.386 . . . . 1.6200000000000001 111.443 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.68 13.61 33.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.446 -0.343 . . . . 1.6499999999999999 110.94 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 57.56 57.84 17.71 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.754 -0.736 . . . . 0.88 112.167 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -169.2 131.29 1.2 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 1.8600000000000001 110.708 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.487 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 57.9 m-85 -75.19 134.92 41.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.916 -0.584 . . . . 0.80000000000000004 110.974 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . . . . . . . . . 11.7 m -128.26 -177.91 2.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 1.73 110.69 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . 0.406 HG23 ' HZ1' ' A' ' 817' ' ' LYS . 2.0 t -99.08 103.41 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.025 0.441 . . . . 1.21 111.74 -179.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.462 HD11 ' O ' ' A' ' 833' ' ' ASP . 8.7 tt -107.54 137.64 45.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.764 -0.653 . . . . 1.52 110.379 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -179.76 32.92 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.269 -0.967 . . . . 1.0900000000000001 113.148 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.47 150.68 30.67 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.877 0.339 . . . . 1.8 110.529 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -51.55 -21.93 2.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.014 0.435 . . . . 2.2000000000000002 110.386 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -71.6 -61.76 1.66 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.585 . . . . 2.21 110.967 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.511 ' O ' ' HB2' ' A' ' 837' ' ' ALA . 0.6 OUTLIER -63.45 -17.94 63.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.812 0.339 . . . . 0.72999999999999998 110.157 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.495 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.8 t-105 -82.4 -42.11 19.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.142 -0.481 . . . . 0.29999999999999999 110.425 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . 0.719 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 16.6 m-80 -71.0 -30.87 67.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.098 0.475 . . . . 2.8500000000000001 110.185 179.18 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 91.2 t -75.74 -53.55 15.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.838 -0.619 . . . . 1.4399999999999999 110.011 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.511 ' HB2' ' O ' ' A' ' 833' ' ' ASP . . . -57.84 -26.12 61.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.057 -0.519 . . . . 1.04 110.492 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.719 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 34.3 mtmt -72.46 -42.71 64.67 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.191 -0.459 . . . . 1.3600000000000001 110.32 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -64.38 -26.39 68.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.963 -0.562 . . . . 1.95 110.305 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 9.3 ttp -74.76 -39.26 61.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.791 -0.64 . . . . 1.0900000000000001 110.443 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.593 HD21 ' HB3' ' A' ' 846' ' ' GLU . 63.4 mt -64.49 -42.72 95.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 1.1799999999999999 110.845 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.471 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.0 -28.66 69.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.223 -0.444 . . . . 1.1799999999999999 111.074 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -70.61 6.94 1.23 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 1.6799999999999999 110.58 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.471 ' H ' ' C ' ' A' ' 842' ' ' ALA . 37.0 m-80 -148.1 14.76 1.03 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.042 -0.526 . . . . 1.96 110.911 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 59.19 18.22 6.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 2.4700000000000002 111.14 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.593 ' HB3' HD21 ' A' ' 841' ' ' LEU . 1.7 mm-40 -79.27 169.88 17.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.34 -0.391 . . . . 2.2999999999999998 110.936 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.8 10.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 2.46 111.195 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.61 ' HB3' HG21 ' A' ' 782' ' ' THR . 49.9 m-85 -117.23 131.68 56.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.821 0.343 . . . . 1.52 110.629 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.692 HD12 ' HB2' ' A' ' 818' ' ' TYR . 0.4 OUTLIER -110.5 123.74 50.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 1.3799999999999999 111.027 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -83.15 141.35 32.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.125 -0.489 . . . . 1.5600000000000001 110.949 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.775 HD13 ' HB3' ' A' ' 781' ' ' PHE . 1.2 mt -133.14 151.55 34.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 116.498 -0.319 . . . . 1.73 111.821 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.601 ' HB2' ' HB2' ' A' ' 817' ' ' LYS . 0.9 OUTLIER -105.68 174.76 5.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 5.6399999999999997 110.767 179.699 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . 0.506 HD11 ' H ' ' A' ' 779' ' ' SER . 0.0 OUTLIER -132.93 40.82 3.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 2.8900000000000001 110.984 179.911 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . 0.43 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 2.6 p90 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.173 -0.917 . . . . 3.3900000000000001 110.995 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.16 0 N-CA-C 112.407 -0.277 . . . . 9.4199999999999999 112.407 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -91.52 -55.1 3.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.8 0.333 . . . . 8.4800000000000004 111.058 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 777' ' ' MET . . . . . 0.4 ' HG3' ' H ' ' A' ' 778' ' ' GLY . 2.0 tpt -154.6 -177.6 6.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.199 -0.455 . . . . 8.6400000000000006 110.87 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . 0.4 ' H ' ' HG3' ' A' ' 777' ' ' MET . . . -169.97 -108.63 0.21 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.836 -0.697 . . . . 4.2800000000000002 112.495 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 55.85 70.83 0.6 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.796 0.331 . . . . 3.0 111.07 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.528 HG23 ' O ' ' A' ' 851' ' ' ILE . 0.0 OUTLIER -138.27 -174.25 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 1.75 111.053 -179.98 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.534 ' HB3' ' CD1' ' A' ' 851' ' ' ILE . 0.0 OUTLIER -149.0 89.44 1.67 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.509 -0.552 . . . . 1.3600000000000001 109.509 179.778 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.553 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -97.53 102.2 13.9 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.911 -0.586 . . . . 1.1899999999999999 111.341 -178.889 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . 0.527 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 8.9 mp -89.48 -176.37 5.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.544 -0.753 . . . . 2.1499999999999999 110.637 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.77 95.04 5.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.829 -0.623 . . . . 1.53 109.523 178.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.465 HG12 ' N ' ' A' ' 786' ' ' GLU . 93.8 t -92.76 146.52 6.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.347 -0.842 . . . . 1.79 111.683 -178.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.465 ' N ' HG12 ' A' ' 785' ' ' VAL . 0.1 OUTLIER -102.41 171.04 7.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.817 -0.629 . . . . 1.3999999999999999 110.629 179.688 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.32 53.55 2.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 3.3399999999999999 110.858 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.7 p -163.35 -22.97 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.981 -0.554 . . . . 1.0900000000000001 110.87 -179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 36.6 m0 -57.07 129.55 42.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.766 -0.652 . . . . 0.34000000000000002 112.118 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.16 166.9 11.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.707 -0.849 . . . . 1.8899999999999999 108.707 178.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -54.58 -23.36 16.51 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.746 -0.382 . . . . 0.73999999999999999 110.076 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.545 ' O ' ' HG3' ' A' ' 796' ' ' MET . 10.0 t70 -73.24 -58.36 3.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.912 -0.585 . . . . 2.0499999999999998 109.919 178.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.39 -33.47 69.66 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 116.265 -0.425 . . . . 1.0700000000000001 110.334 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 24.7 tp -61.56 -51.74 67.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.832 -0.622 . . . . 1.55 110.07 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.682 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 17.8 mm -57.76 -31.47 40.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.54 -0.755 . . . . 1.0800000000000001 111.252 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.4 mtp -67.4 -52.19 42.82 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.7 0.286 . . . . 2.21 110.504 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.5 -53.51 50.5 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.172 -0.467 . . . . 1.0900000000000001 110.241 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.408 HD11 HD13 ' A' ' 851' ' ' ILE . 70.3 mt -58.76 -50.16 80.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.772 -0.649 . . . . 1.1799999999999999 110.768 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.682 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.1 t-20 -55.59 -27.91 52.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.702 -0.681 . . . . 1.2 111.248 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 46.9 t -78.62 -26.14 45.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.354 -0.385 . . . . 1.52 110.743 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . 0.514 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -97.65 -2.03 42.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 2.73 111.298 -179.824 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.793 HD13 HG12 ' A' ' 813' ' ' ILE . 1.0 OUTLIER -113.89 -34.2 2.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.733 0.301 . . . . 1.4099999999999999 111.399 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 803' ' ' SER . . . . . 0.56 ' N ' HG13 ' A' ' 802' ' ' ILE . 14.7 p -124.33 -43.11 2.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 2.0099999999999998 111.159 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . 0.526 ' HB3' ' H ' ' A' ' 805' ' ' THR . 0.2 OUTLIER 57.36 -91.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.095 -0.502 . . . . 3.3900000000000001 111.099 -179.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 805' ' ' THR . . . . . 0.526 ' H ' ' HB3' ' A' ' 804' ' ' ASN . 0.0 OUTLIER -102.15 153.25 20.11 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.337 -0.392 . . . . 4.5899999999999999 111.229 179.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -88.92 13.06 13.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 8.4399999999999995 110.888 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -102.33 31.06 4.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 6.8600000000000003 110.928 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . 0.451 HD21 HD13 ' A' ' 810' ' ' ILE . 2.1 t30 -136.61 6.0 2.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.139 -0.482 . . . . 7.4100000000000001 110.941 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 59.24 56.9 3.65 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.181 -0.463 . . . . 7.1100000000000003 110.943 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . 0.451 HD13 HD21 ' A' ' 808' ' ' ASN . 12.0 mm -118.99 152.07 21.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.106 -0.497 . . . . 5.1699999999999999 110.87 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 811' ' ' SER . . . . . 0.457 ' HA ' ' HD3' ' A' ' 812' ' ' PRO . 0.1 OUTLIER -113.11 120.94 39.29 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.459 . . . . 2.2000000000000002 110.848 179.954 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 811' ' ' SER . 23.1 Cg_exo -64.17 171.3 7.89 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.571 2.181 . . . . 1.3799999999999999 112.011 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.793 HG12 HD13 ' A' ' 802' ' ' ILE . 7.5 pt -132.86 -175.96 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 2.4399999999999999 111.148 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.84 -67.43 0.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.416 -0.357 . . . . 1.73 111.465 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -79.58 119.36 22.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.421 -0.354 . . . . 3.1299999999999999 110.852 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . 0.703 ' HB ' ' HG2' ' A' ' 852' ' ' ARG . 0.2 OUTLIER -133.81 177.4 7.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.071 0.463 . . . . 1.52 111.562 -179.591 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.751 ' HB2' ' HB3' ' A' ' 852' ' ' ARG . 15.1 mmtt -115.47 166.64 11.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.668 -0.696 . . . . 1.4299999999999999 110.111 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.478 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 9.3 p90 -151.58 157.98 42.91 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.042 0.449 . . . . 1.24 111.459 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . 0.49 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 1.6 tt0 -82.78 107.13 15.18 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.819 -0.628 . . . . 2.0899999999999999 110.733 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.751 ' HB2' HG22 ' A' ' 826' ' ' VAL . 12.8 t0 -78.69 178.17 8.07 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.6 -0.727 . . . . 1.8 110.67 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.28 35.49 0.33 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.412 -0.358 . . . . 1.6200000000000001 111.155 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.66 11.96 4.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 1.6499999999999999 110.608 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . 0.459 ' HA2' HE21 ' A' ' 819' ' ' GLN . . . 61.5 47.34 91.22 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.822 -0.704 . . . . 0.88 112.219 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -171.12 133.97 0.9 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.991 0.424 . . . . 1.8600000000000001 110.615 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.478 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 95.2 m-85 -64.12 145.21 56.32 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.891 -0.595 . . . . 0.80000000000000004 110.784 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.751 HG22 ' HB2' ' A' ' 820' ' ' ASP . 0.5 OUTLIER -132.97 177.5 7.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 1.73 110.682 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -99.03 110.39 26.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.886 0.374 . . . . 1.21 111.181 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.536 HD13 ' HB3' ' A' ' 833' ' ' ASP . 6.0 tp -79.93 113.84 18.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.904 -0.589 . . . . 1.52 110.625 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -59.76 -68.88 1.47 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.934 -0.651 . . . . 1.0900000000000001 112.594 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 830' ' ' SER . . . . . 0.457 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.3 OUTLIER -171.41 -142.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.475 0.178 . . . . 1.8 110.538 -179.834 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.457 ' H ' ' HB3' ' A' ' 830' ' ' SER . 10.3 t70 -55.18 -22.61 18.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.69 0.281 . . . . 2.2000000000000002 110.943 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -68.41 -70.85 0.24 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.383 -0.372 . . . . 2.21 110.737 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.536 ' HB3' HD13 ' A' ' 828' ' ' LEU . 0.6 OUTLIER -60.0 -13.34 10.92 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.385 -0.37 . . . . 0.72999999999999998 110.584 179.563 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.524 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.0 OUTLIER -79.86 -45.3 18.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.243 -0.435 . . . . 0.29999999999999999 110.014 179.172 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -67.94 -33.28 74.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.924 -0.58 . . . . 2.8500000000000001 110.224 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 15.7 t -73.92 -52.0 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-N 115.887 -0.597 . . . . 1.4399999999999999 109.879 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.504 ' HB1' ' O ' ' A' ' 833' ' ' ASP . . . -57.97 -26.77 62.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.97 -0.559 . . . . 1.04 110.139 178.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.522 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 0.9 OUTLIER -67.79 -45.97 73.27 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.869 -0.605 . . . . 1.3600000000000001 110.348 179.513 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 0.0 OUTLIER -62.51 -27.76 69.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.1 -0.5 . . . . 1.95 110.225 179.486 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 10.3 ttp -72.21 -36.69 69.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.873 -0.603 . . . . 1.0900000000000001 110.419 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 3.5 mt -73.92 -47.67 36.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.84 -0.618 . . . . 1.1799999999999999 110.833 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.466 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -63.21 -24.45 67.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.065 -0.516 . . . . 1.1799999999999999 111.047 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 14.9 tt0 -65.64 -0.02 1.88 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 1.6799999999999999 110.46 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.466 ' H ' ' C ' ' A' ' 842' ' ' ALA . 9.7 m120 -145.67 17.82 1.47 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.916 -0.584 . . . . 1.96 110.681 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 4.0 m120 59.05 29.79 19.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.5 . . . . 2.4700000000000002 110.887 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -84.34 156.82 21.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 2.2999999999999998 110.831 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -149.13 13.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 2.46 110.995 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.527 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 79.9 m-85 -116.46 116.19 27.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 1.52 110.765 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.553 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.5 OUTLIER -109.44 125.94 52.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.49 . . . . 1.3799999999999999 111.246 -179.615 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.49 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 9.6 m-20 -79.69 160.64 26.21 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.91 -0.587 . . . . 1.5600000000000001 111.062 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.534 ' CD1' ' HB3' ' A' ' 781' ' ' PHE . 17.7 mt -132.41 161.88 40.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 116.49 -0.323 . . . . 1.73 111.628 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.751 ' HB3' ' HB2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -43.81 -81.32 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.258 -0.428 . . . . 5.6399999999999997 111.851 -179.488 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . 0.415 ' H ' ' HG3' ' A' ' 852' ' ' ARG . 0.2 OUTLIER 56.85 45.46 21.51 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.007 0.432 . . . . 2.8900000000000001 110.465 -179.465 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.259 -0.877 . . . . 3.3900000000000001 110.914 -179.811 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.547 -0.221 . . . . 9.4199999999999999 112.547 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 56.35 85.58 0.07 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.892 0.377 . . . . 8.4800000000000004 111.14 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 4.2 mmt -72.7 -47.3 48.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 8.6400000000000006 110.853 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 112.44 173.42 19.11 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.876 -0.678 . . . . 4.2800000000000002 112.488 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 69.0 m -130.17 -69.34 0.67 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.362 . . . . 3.0 110.907 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.499 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER -121.02 172.81 7.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.086 -0.507 . . . . 1.75 111.101 -179.904 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.458 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -149.06 87.02 1.52 Allowed 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.272 -0.422 . . . . 1.3600000000000001 110.194 179.803 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.524 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -98.58 109.93 22.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.872 -0.604 . . . . 1.1899999999999999 111.31 -179.416 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -115.47 -167.99 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.861 -0.609 . . . . 2.1499999999999999 110.726 179.862 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.6 104.28 10.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.956 -0.566 . . . . 1.53 110.161 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 34.7 m -96.7 175.58 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.035 -0.53 . . . . 1.79 111.206 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.66 162.68 26.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.066 -0.516 . . . . 1.3999999999999999 110.764 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.69 2.95 10.67 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.291 -0.413 . . . . 3.3399999999999999 110.889 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.3 p -109.71 -22.9 4.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.521 . . . . 1.0900000000000001 110.689 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -59.17 123.64 17.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.77 -0.65 . . . . 0.34000000000000002 111.902 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . 0.691 HD22 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -96.49 159.76 14.76 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.854 -0.795 . . . . 1.8899999999999999 108.854 178.188 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.42 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 52.0 t80 -42.68 -34.6 0.93 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.646 0.26 . . . . 0.73999999999999999 111.29 -178.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.691 ' HB3' HD22 ' A' ' 790' ' ' ASN . 3.7 t0 -68.85 -55.78 10.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.835 -0.432 . . . . 2.0499999999999998 109.835 178.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . 0.558 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 1.0 OUTLIER -56.08 -25.4 45.29 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.218 0.532 . . . . 1.0700000000000001 109.961 179.078 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.471 HD12 ' CZ2' ' A' ' 834' ' ' TRP . 37.0 tp -71.93 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.396 -0.82 . . . . 1.55 110.241 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.644 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 42.2 mm -55.46 -28.17 22.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.565 -0.743 . . . . 1.0800000000000001 111.541 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.577 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 14.6 mtp -68.26 -50.95 50.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.652 0.263 . . . . 2.21 110.45 179.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -55.52 -53.46 56.15 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.026 0.441 . . . . 1.0900000000000001 110.041 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.57 HD13 HD12 ' A' ' 851' ' ' ILE . 64.3 mt -56.75 -49.74 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.807 -0.633 . . . . 1.1799999999999999 110.557 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.644 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -54.66 -28.26 45.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.7 -0.682 . . . . 1.2 111.273 -179.724 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 35.9 t -78.32 -27.1 47.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.41 -0.359 . . . . 1.52 110.985 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -99.29 0.87 43.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 2.73 111.439 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.582 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.7 pp -117.34 -32.14 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.696 0.284 . . . . 1.4099999999999999 111.397 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 64.0 p -135.99 80.63 1.84 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.922 0.391 . . . . 2.0099999999999998 110.981 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -74.7 -62.75 1.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.042 -0.527 . . . . 3.3900000000000001 110.976 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.18 -72.51 0.12 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.241 -0.436 . . . . 4.5899999999999999 111.299 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -160.8 57.78 0.32 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 8.4399999999999995 110.949 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -155.88 -64.56 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.437 . . . . 6.8600000000000003 110.945 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -72.54 95.41 1.81 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 7.4100000000000001 110.812 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 61.29 177.68 0.11 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.122 -0.49 . . . . 7.1100000000000003 111.152 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 2.7 pt -140.83 156.42 22.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 5.1699999999999999 111.125 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 14.6 m 62.36 106.46 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 116.188 -0.46 . . . . 2.2000000000000002 111.193 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.03 140.14 22.42 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.517 2.145 . . . . 1.3799999999999999 112.426 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.5 HD13 ' H ' ' A' ' 813' ' ' ILE . 0.2 OUTLIER -114.02 172.94 3.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 2.4399999999999999 111.079 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 31.2 p -126.85 -48.44 1.5 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 1.73 111.158 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.5 mptt -80.69 132.05 35.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 3.1299999999999999 110.772 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.1 pp -147.33 174.19 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.43 . . . . 1.52 111.166 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.432 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 16.1 mmtt -120.44 145.33 47.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.038 -0.528 . . . . 1.4299999999999999 110.752 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.537 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 6.0 p90 -124.72 168.54 13.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 1.24 110.996 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -91.38 107.76 19.42 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.042 -0.526 . . . . 2.0899999999999999 110.798 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . 0.735 ' HB2' HG22 ' A' ' 826' ' ' VAL . 3.9 t70 -78.73 168.87 19.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.691 -0.686 . . . . 1.8 110.641 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . 0.401 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.6 OUTLIER -71.48 4.24 3.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.243 -0.435 . . . . 1.6200000000000001 111.361 -179.626 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -99.88 17.0 21.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.398 -0.365 . . . . 1.6499999999999999 110.742 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 55.9 50.51 60.83 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.848 -0.691 . . . . 0.88 112.333 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -172.97 134.6 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.928 0.394 . . . . 1.8600000000000001 110.454 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.537 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 69.3 m-85 -65.76 140.01 58.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.022 -0.536 . . . . 0.80000000000000004 110.666 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.735 HG22 ' HB2' ' A' ' 820' ' ' ASP . 3.1 m -132.48 177.24 7.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 1.73 110.589 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.67 116.17 40.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.049 0.452 . . . . 1.21 111.447 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.76 108.05 13.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.682 -0.69 . . . . 1.52 110.631 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -53.22 -67.14 2.28 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.928 -0.653 . . . . 1.0900000000000001 112.705 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 5.7 p -170.93 -141.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.488 -0.19 . . . . 1.8 110.488 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.32 -23.82 39.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.764 0.316 . . . . 2.2000000000000002 110.874 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.17 -67.94 0.41 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.445 . . . . 2.21 110.674 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.496 ' O ' ' HB3' ' A' ' 837' ' ' ALA . 0.2 OUTLIER -63.05 -13.29 33.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.345 -0.389 . . . . 0.72999999999999998 110.318 179.492 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.536 ' O ' ' HD3' ' A' ' 838' ' ' LYS . 1.6 t-105 -80.46 -40.8 25.55 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.716 -0.476 . . . . 0.29999999999999999 109.716 178.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 31.4 m-80 -76.49 -26.67 55.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.803 -0.635 . . . . 2.8500000000000001 110.132 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . 0.447 HG11 ' N ' ' A' ' 837' ' ' ALA . 0.3 OUTLIER -79.4 -42.76 23.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.831 -0.622 . . . . 1.4399999999999999 109.737 179.327 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 833' ' ' ASP . . . -63.74 -30.19 71.32 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.159 0.504 . . . . 1.04 109.823 178.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.536 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 0.6 OUTLIER -66.7 -48.22 69.94 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.631 -0.713 . . . . 1.3600000000000001 110.447 179.416 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -60.15 -27.63 67.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.066 -0.516 . . . . 1.95 110.512 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 840' ' ' MET . . . . . 0.401 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 8.0 ttp -72.89 -38.21 67.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.952 -0.567 . . . . 1.0900000000000001 110.487 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.463 HD22 ' HB3' ' A' ' 846' ' ' GLU . 7.8 mt -72.77 -18.03 61.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 1.1799999999999999 110.905 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.456 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.92 -29.21 44.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 1.1799999999999999 111.339 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.11 1.08 1.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 1.6799999999999999 110.752 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.456 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.1 OUTLIER -144.82 13.31 1.49 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 1.96 110.855 -179.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 58.4 18.83 5.89 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.156 -0.475 . . . . 2.4700000000000002 111.065 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . 0.463 ' HB3' HD22 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -75.25 166.66 23.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 2.2999999999999998 110.901 179.904 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.16 16.38 0.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 2.46 111.02 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.434 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 68.6 m-85 -112.48 113.11 25.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 1.52 110.723 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.524 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.2 OUTLIER -100.9 130.58 46.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 1.3799999999999999 110.937 -179.75 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.466 ' C ' HG12 ' A' ' 851' ' ' ILE . 3.7 m-20 -96.11 153.98 17.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.187 -0.461 . . . . 1.5600000000000001 111.324 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.57 HD12 HD13 ' A' ' 798' ' ' ILE . 0.8 OUTLIER -135.12 166.14 28.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.069 -0.514 . . . . 1.73 111.066 179.899 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.56 ' HB3' ' HD1' ' A' ' 854' ' ' TYR . 0.1 OUTLIER -120.25 -16.15 8.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.77 0.319 . . . . 5.6399999999999997 110.887 179.682 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . 0.563 HD21 HG23 ' A' ' 851' ' ' ILE . 4.5 mm? 56.86 35.12 25.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 2.8900000000000001 111.394 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . 0.56 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.283 -0.865 . . . . 3.3900000000000001 110.904 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 112.459 -0.256 . . . . 9.4199999999999999 112.459 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 57.53 -161.12 0.23 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.845 0.355 . . . . 8.4800000000000004 111.163 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -82.94 89.54 6.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.147 -0.479 . . . . 8.6400000000000006 110.744 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 112.03 118.08 3.64 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.933 -0.651 . . . . 4.2800000000000002 112.4 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 4.8 t -160.66 -16.77 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.837 0.351 . . . . 3.0 110.713 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.536 HG23 ' HB3' ' A' ' 850' ' ' ASN . 0.2 OUTLIER -138.87 175.23 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.031 -0.531 . . . . 1.75 110.881 179.971 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 781' ' ' PHE . . . . . 0.558 ' HB3' ' CD1' ' A' ' 851' ' ' ILE . 0.3 OUTLIER -142.09 83.65 1.85 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.665 -0.494 . . . . 1.3600000000000001 109.665 179.586 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 782' ' ' THR . . . . . 0.593 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.9 OUTLIER -98.12 123.44 42.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.743 -0.662 . . . . 1.1899999999999999 111.43 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.78 -165.54 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.693 -0.685 . . . . 2.1499999999999999 110.699 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -117.1 104.17 10.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.184 -0.462 . . . . 1.53 110.271 179.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 33.8 m -97.66 -174.75 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.963 -0.562 . . . . 1.79 111.59 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 786' ' ' GLU . . . . . 0.446 ' HG2' HG13 ' A' ' 788' ' ' VAL . 1.1 tt0 -139.22 162.37 35.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.925 -0.58 . . . . 1.3999999999999999 110.759 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 787' ' ' LYS . . . . . 0.435 ' HA ' ' HD2' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -70.92 -7.95 49.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 3.3399999999999999 111.001 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 788' ' ' VAL . . . . . 0.446 HG13 ' HG2' ' A' ' 786' ' ' GLU . 3.0 p -100.33 -25.92 3.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.989 -0.551 . . . . 1.0900000000000001 110.955 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -56.29 121.91 10.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.955 -0.566 . . . . 0.34000000000000002 111.739 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -90.98 165.56 13.48 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.865 -0.791 . . . . 1.8899999999999999 108.865 178.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 791' ' ' PHE . . . . . 0.422 ' O ' HG12 ' A' ' 795' ' ' ILE . 53.3 t80 -52.04 -27.51 13.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.986 0.422 . . . . 0.73999999999999999 110.089 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 792' ' ' ASP . . . . . 0.594 ' O ' ' HG3' ' A' ' 796' ' ' MET . 11.5 m-20 -69.43 -59.71 2.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.568 . . . . 2.0499999999999998 109.815 178.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.14 -32.91 62.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.149 -0.478 . . . . 1.0700000000000001 110.261 179.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.507 HD13 ' CZ2' ' A' ' 834' ' ' TRP . 34.1 tp -62.41 -54.37 41.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.809 -0.632 . . . . 1.55 110.0 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 795' ' ' ILE . . . . . 0.658 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 31.3 mm -58.02 -31.53 41.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.42 -0.809 . . . . 1.0800000000000001 111.696 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 796' ' ' MET . . . . . 0.594 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 20.3 mtt -65.94 -47.8 73.48 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.965 -0.294 . . . . 2.21 110.814 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -56.54 -55.54 32.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.104 0.478 . . . . 1.0900000000000001 109.903 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.557 HD13 HD11 ' A' ' 851' ' ' ILE . 88.6 mt -55.48 -52.49 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.644 -0.707 . . . . 1.1799999999999999 110.628 178.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 799' ' ' ASN . . . . . 0.658 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.5 OUTLIER -55.57 -32.14 62.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.609 -0.723 . . . . 1.2 111.538 -179.56 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.76 -19.3 57.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.887 0.375 . . . . 1.52 110.868 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 801' ' ' LYS . . . . . 0.435 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.1 OUTLIER -106.93 -0.69 22.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.114 -0.494 . . . . 2.73 111.478 -179.907 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 802' ' ' ILE . . . . . 0.58 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.9 pp -119.49 -25.42 2.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.755 0.312 . . . . 1.4099999999999999 111.511 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 93.0 p -140.37 54.64 1.62 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.972 0.415 . . . . 2.0099999999999998 111.082 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -167.33 -26.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.031 -0.531 . . . . 3.3900000000000001 110.973 179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.52 -20.23 44.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 4.5899999999999999 111.083 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.53 -171.86 2.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 8.4399999999999995 110.797 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -129.7 5.43 5.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 6.8600000000000003 110.842 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -98.79 147.57 24.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.471 . . . . 7.4100000000000001 110.982 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -80.85 93.54 6.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.031 -0.531 . . . . 7.1100000000000003 110.814 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.35 -175.38 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 5.1699999999999999 111.055 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.93 122.92 36.7 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 2.2000000000000002 110.777 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 812' ' ' PRO . . . . . 0.405 ' HB3' HD22 ' A' ' 799' ' ' ASN . 35.6 Cg_exo -61.11 -171.05 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.57 2.18 . . . . 1.3799999999999999 112.285 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 813' ' ' ILE . . . . . 0.515 HG13 HD12 ' A' ' 802' ' ' ILE . 1.2 pp -133.13 -175.78 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 2.4399999999999999 111.201 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.02 -50.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 1.73 111.111 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -99.3 117.41 33.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.265 -0.425 . . . . 3.1299999999999999 110.909 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.62 178.9 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.109 -0.496 . . . . 1.52 111.28 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.777 ' H ' ' HG2' ' A' ' 852' ' ' ARG . 19.5 mttt -117.92 163.71 16.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.955 -0.566 . . . . 1.4299999999999999 110.295 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 818' ' ' TYR . . . . . 0.63 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 20.1 p90 -132.93 158.6 42.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.881 0.372 . . . . 1.24 111.145 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 819' ' ' GLN . . . . . 0.692 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 2.3 tp60 -96.2 108.02 20.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.18 0.514 . . . . 2.0899999999999999 110.327 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -79.33 174.82 11.18 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.564 -0.744 . . . . 1.8 110.882 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.8 40.28 0.59 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.101 -0.5 . . . . 1.6200000000000001 111.116 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -140.11 11.76 2.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 1.6499999999999999 110.618 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 61.69 56.23 24.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.83 -0.7 . . . . 0.88 112.338 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -169.99 132.96 1.14 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.956 0.408 . . . . 1.8600000000000001 110.82 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 825' ' ' PHE . . . . . 0.469 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 77.0 m-85 -77.43 129.04 35.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.886 -0.597 . . . . 0.80000000000000004 110.958 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 826' ' ' VAL . . . . . 0.63 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 0.9 OUTLIER -107.65 167.69 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 116.106 -0.497 . . . . 1.73 111.057 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.67 104.48 16.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.267 -0.424 . . . . 1.21 111.055 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 2.2 tt -80.21 125.64 30.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.035 -0.53 . . . . 1.52 110.782 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -81.31 -56.59 2.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.784 -0.722 . . . . 1.0900000000000001 112.775 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 50.6 p -171.28 -141.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.415 -0.217 . . . . 1.8 110.415 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 10.4 p-10 -57.58 -15.43 7.34 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.648 0.261 . . . . 2.2000000000000002 110.908 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -68.48 -76.32 0.09 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.313 -0.403 . . . . 2.21 110.699 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 833' ' ' ASP . . . . . 0.602 ' O ' ' HB1' ' A' ' 837' ' ' ALA . 0.1 OUTLIER -62.68 -11.49 17.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.34 -0.391 . . . . 0.72999999999999998 110.365 179.541 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 834' ' ' TRP . . . . . 0.507 ' CZ2' HD13 ' A' ' 794' ' ' LEU . 1.4 t-105 -79.95 -38.53 32.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.138 0.494 . . . . 0.29999999999999999 109.931 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 835' ' ' ASN . . . . . 0.669 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -76.14 -34.28 59.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.768 -0.651 . . . . 2.8500000000000001 110.005 179.018 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -72.18 -43.93 65.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.484 -0.78 . . . . 1.4399999999999999 109.861 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 837' ' ' ALA . . . . . 0.602 ' HB1' ' O ' ' A' ' 833' ' ' ASP . . . -69.0 -25.25 64.42 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.207 -0.451 . . . . 1.04 110.115 178.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 838' ' ' LYS . . . . . 0.669 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 30.3 mtmt -72.91 -40.9 65.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.958 -0.565 . . . . 1.3600000000000001 110.066 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 -64.68 -31.48 72.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.97 -0.559 . . . . 1.95 110.039 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 10.2 ttp -67.81 -38.96 83.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.829 -0.623 . . . . 1.0900000000000001 110.14 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 841' ' ' LEU . . . . . 0.434 HD11 HD21 ' A' ' 849' ' ' LEU . 47.1 mt -69.61 -37.68 76.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.82 -0.627 . . . . 1.1799999999999999 110.725 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 842' ' ' ALA . . . . . 0.452 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -67.8 -29.69 68.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 1.1799999999999999 111.083 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -67.31 1.89 1.95 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.114 -0.493 . . . . 1.6799999999999999 110.614 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 844' ' ' ASN . . . . . 0.452 ' H ' ' C ' ' A' ' 842' ' ' ALA . 13.6 m120 -142.76 17.18 1.98 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 1.96 110.928 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 59.51 15.87 4.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.177 -0.465 . . . . 2.4700000000000002 111.041 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -79.75 166.25 21.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 2.2999999999999998 110.85 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.01 12.46 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 2.46 110.949 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 848' ' ' PHE . . . . . 0.593 ' HB3' HG22 ' A' ' 782' ' ' THR . 5.2 m-85 -108.3 127.63 54.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 1.52 110.973 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 849' ' ' LEU . . . . . 0.581 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.4 OUTLIER -118.28 128.98 55.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.151 -0.477 . . . . 1.3799999999999999 110.973 -179.798 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 850' ' ' ASN . . . . . 0.692 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 6.7 m120 -89.22 167.32 13.19 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.948 -0.569 . . . . 1.5600000000000001 111.313 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 851' ' ' ILE . . . . . 0.558 ' CD1' ' HB3' ' A' ' 781' ' ' PHE . 53.3 mt -130.75 160.19 42.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.404 -0.362 . . . . 1.73 111.314 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 852' ' ' ARG . . . . . 0.777 ' HG2' ' H ' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -45.96 -92.36 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.274 -0.421 . . . . 5.6399999999999997 111.732 -179.52 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 53.59 29.31 9.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.55 -0.296 . . . . 2.8900000000000001 111.256 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 2.8 p90 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.268 -0.872 . . . . 3.3900000000000001 110.993 179.869 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.507 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 1.1 mt . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.742 0.306 . . . . 1.22 110.927 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.759 ' HB2' ' HB ' ' A' ' 851' ' ' ILE . 0.7 OUTLIER -143.39 84.72 1.82 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.268 -0.423 . . . . 0.93999999999999995 110.366 179.735 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.624 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.2 OUTLIER -98.0 103.28 15.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.905 -0.589 . . . . 0.67000000000000004 110.6 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.717 HD22 ' HE2' ' A' ' 801' ' ' LYS . 0.1 OUTLIER -112.56 -166.44 1.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.626 -0.715 . . . . 1.5700000000000001 110.732 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.79 112.06 19.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.056 -0.52 . . . . 0.81000000000000005 110.035 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 10.1 m -103.67 157.1 5.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.998 -0.546 . . . . 1.1799999999999999 111.138 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.548 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 4.1 tp10 -102.8 170.45 7.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 1.3999999999999999 110.978 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 787' ' ' LYS . . . . . 0.548 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.4 OUTLIER -83.65 27.04 0.64 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 2.8500000000000001 110.6 179.752 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -136.58 -25.44 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.932 -0.576 . . . . 0.33000000000000002 110.57 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -52.6 123.15 10.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.702 -0.681 . . . . 0.29999999999999999 111.939 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.98 166.03 12.9 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.733 -0.84 . . . . 1.8899999999999999 108.733 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.495 ' O ' HG12 ' A' ' 795' ' ' ILE . 93.0 t80 -52.71 -28.46 22.05 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.693 -0.403 . . . . 0.63 110.165 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.515 ' O ' ' HG3' ' A' ' 796' ' ' MET . 14.6 t70 -68.75 -56.24 8.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.07 -0.514 . . . . 2.0499999999999998 109.702 178.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 793' ' ' ASP . . . . . 0.459 ' HA ' ' HG3' ' A' ' 796' ' ' MET . 1.2 t0 -57.44 -33.05 67.52 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.969 -0.56 . . . . 1.0700000000000001 110.232 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.51 HD22 ' CE2' ' A' ' 834' ' ' TRP . 30.5 tp -63.69 -53.16 55.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.864 -0.607 . . . . 0.93000000000000005 109.91 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.66 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 35.8 mm -56.62 -27.01 24.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.645 -0.707 . . . . 0.32000000000000001 111.23 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.515 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 10.5 mtp -67.66 -46.95 70.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.724 0.297 . . . . 1.53 110.458 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 797' ' ' ALA . . . . . 0.439 ' O ' ' HD3' ' A' ' 801' ' ' LYS . . . -56.87 -53.68 55.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.037 0.446 . . . . 0.38 109.935 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.529 HD11 HD12 ' A' ' 851' ' ' ILE . 75.4 mt -57.95 -51.44 70.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.746 -0.661 . . . . 0.5 110.616 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.66 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t-20 -56.27 -26.96 53.65 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.519 -0.764 . . . . 0.81000000000000005 111.325 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.11 -23.47 41.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.317 -0.401 . . . . 0.97999999999999998 110.614 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 801' ' ' LYS . . . . . 0.717 ' HE2' HD22 ' A' ' 783' ' ' LEU . 0.5 OUTLIER -101.08 -1.67 33.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.952 -0.567 . . . . 2.25 111.179 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.673 HD13 HG12 ' A' ' 813' ' ' ILE . 1.4 pp -117.14 -29.42 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.453 -0.34 . . . . 0.75 111.349 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 803' ' ' SER . . . . . 0.515 ' HB2' HD12 ' A' ' 802' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.283 -0.417 . . . . 1.53 110.871 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 C--O 1.232 0.202 0 CA-C-O 120.772 0.239 . . . . 0.94999999999999996 112.486 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.673 HG12 HD13 ' A' ' 802' ' ' ILE . 4.4 pt -145.05 171.87 5.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.122 -0.49 . . . . 1.9399999999999999 110.931 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 3.2 p -144.57 -53.81 0.32 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.319 -0.401 . . . . 1.1599999999999999 111.271 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -81.98 114.92 20.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 2.6899999999999999 110.767 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 816' ' ' ILE . . . . . 0.595 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -136.08 169.27 20.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.232 -0.44 . . . . 0.83999999999999997 111.318 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 8.9 mttt -110.58 166.68 10.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.025 -0.534 . . . . 0.84999999999999998 110.421 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.571 ' CE1' HG23 ' A' ' 826' ' ' VAL . 10.6 p90 -149.77 152.94 36.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.973 0.416 . . . . 0.70999999999999996 111.377 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 819' ' ' GLN . . . . . 0.41 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -76.74 108.01 9.45 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.933 -0.576 . . . . 1.9099999999999999 110.672 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.544 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.0 t70 -78.97 179.3 7.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.383 -0.826 . . . . 1.8 110.792 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.71 35.96 0.53 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 1.6200000000000001 111.051 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.33 16.27 3.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.32 -0.4 . . . . 1.6499999999999999 110.999 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 60.98 46.45 94.55 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.787 -0.721 . . . . 0.88 112.319 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -174.02 134.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.972 0.415 . . . . 1.8600000000000001 110.65 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.421 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 72.5 m-85 -65.7 144.97 56.58 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.944 -0.571 . . . . 0.64000000000000001 110.766 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.571 HG23 ' CE1' ' A' ' 818' ' ' TYR . 1.0 OUTLIER -130.03 179.56 4.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.96999999999999997 110.903 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.7 113.57 33.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.981 0.42 . . . . 0.56000000000000005 111.397 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.97 131.5 34.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.804 -0.634 . . . . 0.81000000000000005 110.725 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -76.76 -68.52 1.51 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.723 -0.751 . . . . 0.81000000000000005 112.669 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 90.7 p -170.17 -137.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.38 -0.23 . . . . 1.3100000000000001 110.38 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -54.45 -27.93 40.81 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.907 0.384 . . . . 2.2000000000000002 110.65 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.544 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.9 OUTLIER -63.92 -68.41 0.35 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.08 -0.509 . . . . 2.21 110.882 179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -11.28 28.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.3 -0.409 . . . . 0.72999999999999998 110.674 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.516 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.5 t-105 -82.86 -41.65 18.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.26000000000000001 110.176 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 54.9 m-20 -73.42 -27.33 61.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.048 -0.524 . . . . 1.98 110.001 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 832' ' ' GLU . 51.0 t -78.84 -51.42 17.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.771 -0.65 . . . . 0.67000000000000004 109.928 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.45 66.34 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.991 -0.55 . . . . 0.22 110.314 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.428 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 1.7 mtpp -67.16 -49.34 65.09 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.877 -0.602 . . . . 0.84999999999999998 110.467 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.88 -24.77 66.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 1.95 110.334 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.9 ttp -75.56 -34.05 60.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.84 -0.618 . . . . 0.29999999999999999 110.37 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.805 HD11 HD23 ' A' ' 849' ' ' LEU . 27.8 mt -69.98 -47.42 62.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.915 -0.584 . . . . 0.46999999999999997 110.803 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.53 -3.64 44.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.48999999999999999 111.404 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -3.49 2.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.971 0.415 . . . . 1.6799999999999999 110.171 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.416 ' H ' ' C ' ' A' ' 842' ' ' ALA . 1.5 m120 -145.35 -73.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.771 -0.649 . . . . 1.96 110.322 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -179.26 27.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.833 -0.622 . . . . 1.99 110.921 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.22 142.96 30.98 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.291 -0.413 . . . . 2.2999999999999998 110.913 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -132.91 -16.65 2.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.947 -0.569 . . . . 1.98 110.698 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.624 ' HB3' HG22 ' A' ' 782' ' ' THR . 32.7 m-85 -84.46 144.9 28.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.171 -0.468 . . . . 1.0900000000000001 111.133 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.805 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -124.42 131.19 53.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.935 -0.575 . . . . 0.73999999999999999 110.516 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.446 ' C ' HG12 ' A' ' 851' ' ' ILE . 7.3 m-80 -89.87 153.58 20.53 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.885 -0.598 . . . . 1.52 111.185 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.759 ' HB ' ' HB2' ' A' ' 781' ' ' PHE . 1.5 mm . . . . . 0 C--N 1.333 -0.15 0 CA-C-N 116.123 -0.49 . . . . 1.04 111.413 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.756 0.312 . . . . 1.22 110.949 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 1.001 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.3 OUTLIER -153.77 92.05 1.52 Allowed 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.053 0.454 . . . . 0.93999999999999995 110.006 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.561 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -97.43 97.93 9.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.736 -0.666 . . . . 0.67000000000000004 110.89 -179.349 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.5 OUTLIER -91.56 146.73 23.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.595 -0.73 . . . . 1.5700000000000001 111.086 -179.671 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.78 108.98 12.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.404 . . . . 0.81000000000000005 110.555 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 847' ' ' LYS . 17.3 m -98.48 -166.6 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.898 -0.592 . . . . 1.1799999999999999 111.371 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.582 ' HG2' HG12 ' A' ' 788' ' ' VAL . 0.8 OUTLIER -140.37 171.55 13.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.278 -0.419 . . . . 1.3999999999999999 111.003 -179.856 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.03 20.15 2.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 2.8500000000000001 110.853 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 788' ' ' VAL . . . . . 0.582 HG12 ' HG2' ' A' ' 786' ' ' GLU . 1.7 p -136.18 -26.33 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.777 -0.647 . . . . 0.33000000000000002 110.72 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 24.5 m0 -51.92 126.63 18.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.935 -0.575 . . . . 0.29999999999999999 111.848 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.11 168.67 10.96 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.051 -0.722 . . . . 1.8899999999999999 109.051 178.313 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.407 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 69.8 t80 -54.4 -24.75 21.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.011 0.434 . . . . 0.63 110.06 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.654 ' O ' ' HG3' ' A' ' 796' ' ' MET . 26.3 t0 -73.19 -61.78 1.7 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.803 -0.635 . . . . 2.0499999999999998 109.851 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -54.01 -27.35 31.31 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.159 -0.473 . . . . 1.0700000000000001 110.045 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.576 HD22 ' CE2' ' A' ' 834' ' ' TRP . 32.1 tp -68.55 -58.12 4.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.783 -0.644 . . . . 0.93000000000000005 110.403 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.7 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 19.9 mm -56.86 -32.24 38.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.521 -0.763 . . . . 0.32000000000000001 111.647 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.654 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.5 mtt -66.81 -52.87 38.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.7 0.286 . . . . 1.53 110.601 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.89 -54.94 31.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.022 0.439 . . . . 0.38 110.192 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 46.6 mt -56.26 -48.77 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.763 -0.653 . . . . 0.5 110.52 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.7 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.2 t-20 -57.96 -23.84 55.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.871 -0.604 . . . . 0.81000000000000005 111.099 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.81 -24.21 38.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.031 0.444 . . . . 0.97999999999999998 110.316 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 801' ' ' LYS . . . . . 0.519 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -101.85 -2.34 30.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.766 -0.652 . . . . 2.25 111.297 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.57 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.8 pp -121.2 -25.11 2.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.79 0.328 . . . . 0.75 111.414 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 44.1 t . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.285 -0.416 . . . . 1.53 110.825 -179.905 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo . . . . . 0 N--CA 1.47 0.14 0 CA-C-O 120.819 0.258 . . . . 0.94999999999999996 112.269 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 42.2 pt -136.22 154.68 33.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.9 0.381 . . . . 1.9399999999999999 111.436 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 9.8 p -133.44 -64.23 0.73 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.969 -0.559 . . . . 1.1599999999999999 110.824 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.44 123.38 32.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.486 . . . . 2.6899999999999999 110.31 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.7 pp -144.65 174.14 3.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.066 0.46 . . . . 0.83999999999999997 111.89 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -105.54 172.94 6.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.649 -0.705 . . . . 0.84999999999999998 110.32 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.576 ' CE1' HG23 ' A' ' 826' ' ' VAL . 9.0 p90 -158.03 163.01 38.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.932 0.396 . . . . 0.70999999999999996 111.421 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 819' ' ' GLN . . . . . 0.491 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -82.32 107.59 15.11 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.902 -0.59 . . . . 1.9099999999999999 110.713 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.446 ' HB3' HG22 ' A' ' 826' ' ' VAL . 0.2 OUTLIER -79.02 -178.76 6.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.479 -0.782 . . . . 1.8 110.795 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -82.86 38.61 0.59 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.294 -0.412 . . . . 1.6200000000000001 111.284 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -140.16 9.1 2.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.34 -0.391 . . . . 1.6499999999999999 110.848 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 65.1 49.08 63.96 Favored Glycine 0 C--N 1.331 0.258 0 C-N-CA 120.682 -0.771 . . . . 0.88 112.287 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -169.29 134.3 1.5 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.982 0.42 . . . . 1.8600000000000001 110.617 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.511 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 94.5 m-85 -63.69 136.03 57.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.881 -0.599 . . . . 0.64000000000000001 110.871 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.576 HG23 ' CE1' ' A' ' 818' ' ' TYR . 3.0 m -126.46 179.15 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 0.96999999999999997 110.595 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.93 114.53 36.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.954 0.407 . . . . 0.56000000000000005 111.537 -179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 4.8 tp -83.17 122.44 28.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.809 -0.632 . . . . 0.81000000000000005 110.86 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.29 -75.36 0.48 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.783 -0.722 . . . . 0.81000000000000005 112.619 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -161.75 -141.97 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 110.499 -0.186 . . . . 1.3100000000000001 110.499 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -59.41 -16.39 22.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.729 0.3 . . . . 2.2000000000000002 110.84 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.553 ' O ' HG23 ' A' ' 836' ' ' VAL . 29.1 mt-10 -75.05 -66.32 0.77 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.235 -0.439 . . . . 2.21 110.613 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -61.59 -15.15 36.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.285 -0.416 . . . . 0.72999999999999998 110.263 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.576 ' CE2' HD22 ' A' ' 794' ' ' LEU . 2.8 t-105 -82.37 -39.27 22.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.26000000000000001 109.59 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.721 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -69.61 -37.74 76.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.86 -0.609 . . . . 1.98 109.751 178.776 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 832' ' ' GLU . 24.3 t -69.88 -54.65 18.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.557 -0.747 . . . . 0.67000000000000004 109.675 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.97 -24.72 40.14 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.855 -0.612 . . . . 0.22 110.324 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.721 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 27.8 mtmt -71.88 -45.49 61.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.835 -0.62 . . . . 0.84999999999999998 110.317 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -65.22 -17.64 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.835 -0.621 . . . . 1.95 110.349 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 6.2 ttp -83.46 -33.85 25.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.683 -0.69 . . . . 0.29999999999999999 110.403 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.911 HD11 HD23 ' A' ' 849' ' ' LEU . 20.5 mt -68.84 -45.79 70.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.46999999999999997 110.898 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -64.88 -28.14 69.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.48999999999999999 111.407 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.81 8.26 0.93 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.227 -0.442 . . . . 1.6799999999999999 110.74 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.434 ' H ' ' C ' ' A' ' 842' ' ' ALA . 11.2 m-80 -146.53 16.56 1.29 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.018 -0.537 . . . . 1.96 110.802 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 59.93 19.6 8.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.051 -0.522 . . . . 1.99 111.128 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 846' ' ' GLU . . . . . 0.438 ' HB3' HD22 ' A' ' 841' ' ' LEU . 3.2 mt-10 -83.5 170.85 13.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.422 -0.354 . . . . 2.2999999999999998 110.654 179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 847' ' ' LYS . . . . . 0.487 ' O ' HG22 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -152.07 -30.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.425 -0.352 . . . . 1.98 111.273 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.462 ' HB3' ' HB ' ' A' ' 782' ' ' THR . 4.1 m-85 -82.4 143.09 31.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.918 0.39 . . . . 1.0900000000000001 111.041 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.911 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -122.29 121.33 36.5 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.04 -0.527 . . . . 0.73999999999999999 110.744 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.491 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 4.6 m-20 -75.45 161.65 29.03 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.993 -0.549 . . . . 1.52 111.327 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 1.001 HD12 ' HB3' ' A' ' 781' ' ' PHE . 6.0 mt . . . . . 0 C--N 1.334 -0.104 0 CA-C-N 116.184 -0.462 . . . . 1.04 111.025 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.496 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.711 0.291 . . . . 1.22 110.855 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.659 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.37 97.45 1.23 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.985 0.422 . . . . 0.93999999999999995 109.911 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.526 HG23 ' OD1' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -96.86 94.14 7.07 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.297 0.57 . . . . 0.67000000000000004 110.765 -179.438 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.445 ' HA ' HD22 ' A' ' 783' ' ' LEU . 0.2 OUTLIER -92.16 114.65 27.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.42 -0.809 . . . . 1.5700000000000001 111.036 -179.489 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.486 HD12 ' HE1' ' A' ' 848' ' ' PHE . 6.8 tt -62.12 103.99 0.43 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.072 -0.513 . . . . 0.81000000000000005 110.535 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.445 HG21 ' HH2' ' A' ' 834' ' ' TRP . 26.3 m -98.4 -172.0 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.979 -0.555 . . . . 1.1799999999999999 111.413 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.43 176.27 8.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.138 -0.483 . . . . 1.3999999999999999 110.882 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.98 35.46 0.79 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.097 0.475 . . . . 2.8500000000000001 110.806 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.0 p -150.77 -28.38 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.674 -0.694 . . . . 0.33000000000000002 110.896 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 23.3 m0 -49.06 124.24 8.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.826 -0.624 . . . . 0.29999999999999999 111.736 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.66 166.66 12.68 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.142 -0.688 . . . . 1.8899999999999999 109.142 178.346 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.433 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 77.2 t80 -52.83 -24.1 8.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.944 0.402 . . . . 0.63 110.172 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.656 ' O ' ' HG3' ' A' ' 796' ' ' MET . 2.1 t70 -72.25 -62.49 1.42 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.868 -0.605 . . . . 2.0499999999999998 109.697 178.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -53.63 -27.02 24.71 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 116.158 -0.474 . . . . 1.0700000000000001 110.356 179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.627 HD22 ' CE2' ' A' ' 834' ' ' TRP . 26.9 tp -70.19 -54.34 13.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.858 -0.61 . . . . 0.93000000000000005 110.478 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.687 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 23.5 mm -59.23 -34.1 52.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.654 -0.703 . . . . 0.32000000000000001 111.868 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.656 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 21.8 mtm -71.17 -43.4 67.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.636 0.255 . . . . 1.53 111.067 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.95 79.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.272 0.558 . . . . 0.38 109.975 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.474 ' O ' HG23 ' A' ' 802' ' ' ILE . 48.1 mt -62.94 -47.8 91.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.446 -0.797 . . . . 0.5 110.281 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.742 ' HA ' HG12 ' A' ' 802' ' ' ILE . 0.8 OUTLIER -56.13 -29.58 60.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.846 -0.616 . . . . 0.81000000000000005 111.133 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.84 -29.49 58.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.97999999999999998 110.848 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 801' ' ' LYS . . . . . 0.539 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -94.41 -3.93 49.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 2.25 111.467 -179.77 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.742 HG12 ' HA ' ' A' ' 799' ' ' ASN . 7.0 pt -113.76 -22.15 5.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.761 0.315 . . . . 0.75 111.244 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.258 -0.428 . . . . 1.53 111.006 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.833 0.264 . . . . 0.94999999999999996 112.484 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 4.4 mm -107.61 148.7 11.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 1.9399999999999999 111.092 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 82.1 p -115.94 -47.2 2.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.25 -0.432 . . . . 1.1599999999999999 111.374 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.94 139.18 30.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.266 -0.425 . . . . 2.6899999999999999 111.093 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -150.63 168.77 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.126 -0.488 . . . . 0.83999999999999997 111.169 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.638 ' HE2' HG13 ' A' ' 827' ' ' VAL . 14.6 mmtt -115.45 134.63 54.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 0.84999999999999998 110.646 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.602 ' CE1' HG23 ' A' ' 826' ' ' VAL . 5.4 p90 -113.33 168.48 9.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.893 0.378 . . . . 0.70999999999999996 111.26 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -93.68 105.99 17.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.975 -0.557 . . . . 1.9099999999999999 110.761 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.456 ' HB2' HG22 ' A' ' 826' ' ' VAL . 4.6 t0 -79.07 169.65 17.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.83 -0.623 . . . . 1.8 110.373 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.9 52.65 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.189 0.518 . . . . 1.6200000000000001 111.105 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 -141.05 1.5 1.65 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.679 -0.691 . . . . 1.6499999999999999 110.463 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 74.6 44.44 26.39 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.882 -0.675 . . . . 0.88 111.982 -179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -174.08 142.44 0.84 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 121.164 0.507 . . . . 1.8600000000000001 110.57 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.438 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 70.6 m-85 -72.25 147.26 46.64 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.625 -0.716 . . . . 0.64000000000000001 110.462 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.602 HG23 ' CE1' ' A' ' 818' ' ' TYR . 2.4 m -137.48 177.92 5.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.305 -0.407 . . . . 0.96999999999999997 110.726 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 827' ' ' VAL . . . . . 0.638 HG13 ' HE2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -98.93 118.65 45.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.019 0.438 . . . . 0.56000000000000005 111.35 -179.626 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.457 HD12 ' HB3' ' A' ' 833' ' ' ASP . 3.5 tp -79.75 113.67 18.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.767 -0.651 . . . . 0.81000000000000005 110.745 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -58.01 -71.75 0.7 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.995 -0.621 . . . . 0.81000000000000005 112.751 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 57.4 p -171.07 -136.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.502 0.191 . . . . 1.3100000000000001 110.732 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.459 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 0.7 OUTLIER -57.85 -20.59 37.44 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.771 0.32 . . . . 2.2000000000000002 110.967 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.487 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.5 OUTLIER -72.62 -68.29 0.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.428 . . . . 2.21 110.947 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 833' ' ' ASP . . . . . 0.457 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.6 OUTLIER -60.9 -13.35 15.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.72999999999999998 110.793 179.776 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.627 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.5 t-105 -86.26 -40.38 15.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.9 0.381 . . . . 0.26000000000000001 110.111 179.281 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.743 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -68.91 -37.09 78.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.95 -0.568 . . . . 1.98 109.885 179.064 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 832' ' ' GLU . 39.9 t -72.25 -54.47 16.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.462 -0.79 . . . . 0.67000000000000004 110.149 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.01 -25.48 61.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.0 -0.545 . . . . 0.22 110.601 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.743 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 23.8 mtmt -69.73 -42.67 73.66 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.169 -0.469 . . . . 0.84999999999999998 110.191 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 839' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 5.0 mt-10 -68.11 -25.93 65.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.061 -0.518 . . . . 1.95 110.161 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 12.4 ttp -74.97 -35.72 62.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.746 -0.661 . . . . 0.29999999999999999 110.497 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.646 HD11 HD23 ' A' ' 849' ' ' LEU . 15.4 mt -67.69 -49.21 63.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.46999999999999997 110.917 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 842' ' ' ALA . . . . . . . . . . . . . . . -80.46 -0.34 36.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.48999999999999999 111.544 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 843' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 0.5 OUTLIER -66.43 -0.86 2.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.998 0.428 . . . . 1.6799999999999999 110.377 179.466 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 844' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -149.74 -71.2 0.19 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.847 -0.615 . . . . 1.96 110.63 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -177.82 26.33 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.959 -0.564 . . . . 1.99 111.162 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -100.62 140.93 34.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.824 0.345 . . . . 2.2999999999999998 110.876 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.3 2.84 2.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 1.98 110.931 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.486 ' HE1' HD12 ' A' ' 784' ' ' LEU . 0.5 OUTLIER -111.02 126.03 54.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.358 -0.383 . . . . 1.0900000000000001 110.947 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.646 HD23 HD11 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -97.37 133.32 42.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.083 -0.508 . . . . 0.73999999999999999 110.697 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.526 ' OD1' HG23 ' A' ' 782' ' ' THR . 6.5 m-20 -85.59 153.93 22.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 1.52 111.197 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.659 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.4 mm . . . . . 0 C--N 1.332 -0.161 0 CA-C-N 116.202 -0.454 . . . . 1.04 111.096 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.45 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.074 0 CA-C-O 120.676 0.274 . . . . 1.22 110.719 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.706 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -133.59 78.44 1.77 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.112 0.482 . . . . 0.93999999999999995 110.113 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.1 OUTLIER -98.46 115.7 29.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.67000000000000004 111.378 -179.401 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.51 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -116.9 -167.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.709 -0.678 . . . . 1.5700000000000001 110.672 179.832 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -116.34 110.92 19.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.028 -0.533 . . . . 0.81000000000000005 110.372 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.639 HG21 ' HH2' ' A' ' 834' ' ' TRP . 28.8 m -107.45 158.57 7.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 1.1799999999999999 111.539 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.618 ' HG2' HG12 ' A' ' 788' ' ' VAL . 1.1 tt0 -110.18 171.06 7.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.983 -0.553 . . . . 1.3999999999999999 110.725 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -79.19 -9.36 59.54 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.039 0.447 . . . . 2.8500000000000001 110.783 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 788' ' ' VAL . . . . . 0.618 HG12 ' HG2' ' A' ' 786' ' ' GLU . 2.7 p -96.06 -24.26 4.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.785 -0.643 . . . . 0.33000000000000002 110.848 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -56.73 126.17 25.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.29999999999999999 111.931 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.85 167.94 10.79 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.009 -0.737 . . . . 1.8899999999999999 109.009 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.442 ' O ' HG12 ' A' ' 795' ' ' ILE . 80.6 t80 -54.67 -24.3 21.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.885 0.374 . . . . 0.63 110.069 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 796' ' ' MET . 24.1 m-20 -73.58 -57.6 3.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.979 -0.555 . . . . 2.0499999999999998 109.758 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.31 -30.5 64.8 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.166 -0.47 . . . . 1.0700000000000001 110.124 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.531 HD13 ' CZ2' ' A' ' 834' ' ' TRP . 30.2 tp -65.46 -54.72 24.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.712 -0.676 . . . . 0.93000000000000005 110.281 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.656 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 30.3 mm -57.25 -27.98 29.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.484 -0.78 . . . . 0.32000000000000001 111.535 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.5 mtt -68.18 -51.01 50.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.716 0.294 . . . . 1.53 110.548 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.04 -53.06 58.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.057 0.456 . . . . 0.38 109.911 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.469 HG21 HD11 ' A' ' 813' ' ' ILE . 74.2 mt -57.49 -53.02 49.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.643 -0.708 . . . . 0.5 110.428 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.656 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 2.5 t30 -54.96 -24.64 24.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.563 -0.744 . . . . 0.81000000000000005 111.283 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 42.1 t -78.79 -27.56 44.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.349 -0.387 . . . . 0.97999999999999998 110.537 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.41 4.6 36.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.985 -0.552 . . . . 2.25 111.358 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.568 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.0 OUTLIER -127.22 -23.63 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 111.933 0.346 . . . . 0.75 111.933 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 C--N 1.33 -0.24 0 CA-C-O 120.729 0.299 . . . . 1.53 111.078 -179.717 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo . . . . . 0 C--O 1.231 0.148 0 CA-C-O 120.728 0.22 . . . . 0.94999999999999996 112.105 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.544 HG12 HD13 ' A' ' 802' ' ' ILE . 8.7 pt -140.93 -176.25 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.959 0.409 . . . . 1.9399999999999999 111.294 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 1.6 t -158.57 -40.42 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.97 -0.559 . . . . 1.1599999999999999 110.981 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.79 126.92 52.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.081 -0.509 . . . . 2.6899999999999999 110.821 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -155.27 -176.17 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 0.83999999999999997 111.365 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 851' ' ' ILE . 17.5 mmtt -108.64 169.67 8.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.84999999999999998 110.595 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.506 ' CE1' HG23 ' A' ' 826' ' ' VAL . 11.0 p90 -157.29 157.25 33.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.988 0.423 . . . . 0.70999999999999996 111.191 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 819' ' ' GLN . . . . . 0.513 ' HA ' ' O ' ' A' ' 824' ' ' ASP . 55.3 tt0 -76.33 102.15 5.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.897 -0.592 . . . . 1.9099999999999999 111.039 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.5 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.2 t0 -79.24 -176.01 4.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.587 -0.733 . . . . 1.8 110.627 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -81.79 15.13 2.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.362 -0.381 . . . . 1.6200000000000001 111.185 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.34 6.11 44.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.432 . . . . 1.6499999999999999 111.07 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 75.2 16.35 80.65 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.736 . . . . 0.88 112.482 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 824' ' ' ASP . . . . . 0.513 ' O ' ' HA ' ' A' ' 819' ' ' GLN . 2.8 t0 -143.49 -147.35 0.21 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.754 0.311 . . . . 1.8600000000000001 110.358 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.412 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 49.3 m-85 -129.02 150.89 50.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.295 -0.411 . . . . 0.64000000000000001 110.895 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.506 HG23 ' CE1' ' A' ' 818' ' ' TYR . 8.4 m -139.14 -178.58 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.96999999999999997 110.558 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -98.64 113.41 33.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.969 0.414 . . . . 0.56000000000000005 111.682 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -80.36 120.27 24.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.909 -0.587 . . . . 0.81000000000000005 110.63 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -68.48 -72.5 0.81 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.847 -0.692 . . . . 0.81000000000000005 112.621 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.79 -136.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.492 0.187 . . . . 1.3100000000000001 110.51 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -59.61 -16.26 24.52 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.702 0.287 . . . . 2.2000000000000002 110.822 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.532 ' O ' HG23 ' A' ' 836' ' ' VAL . 32.0 mt-10 -74.89 -70.4 0.41 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.284 -0.417 . . . . 2.21 110.827 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -61.77 -11.76 13.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.72999999999999998 110.841 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.639 ' HH2' HG21 ' A' ' 785' ' ' VAL . 2.0 t-105 -84.01 -40.7 18.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.891 0.377 . . . . 0.26000000000000001 110.17 179.296 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.719 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -69.07 -35.22 76.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 1.98 110.024 179.112 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 832' ' ' GLU . 13.2 t -74.71 -53.56 16.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.67000000000000004 110.132 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -56.57 -27.16 57.22 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.124 -0.489 . . . . 0.22 110.488 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.719 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 21.4 mtmt -68.55 -47.89 65.71 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.988 -0.551 . . . . 0.84999999999999998 110.336 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.97 -25.63 67.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.485 . . . . 1.95 110.27 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.7 ttp -73.05 -35.21 66.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.779 -0.646 . . . . 0.29999999999999999 110.269 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.716 HD11 HD23 ' A' ' 849' ' ' LEU . 6.0 mt -67.67 -50.76 56.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.825 -0.625 . . . . 0.46999999999999997 110.659 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.403 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.18 -2.28 36.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.11 -0.495 . . . . 0.48999999999999999 111.263 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.85 -4.92 2.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.001 0.429 . . . . 1.6799999999999999 110.211 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.403 ' H ' ' C ' ' A' ' 842' ' ' ALA . 3.1 m120 -147.67 -71.22 0.22 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.633 -0.712 . . . . 1.96 110.538 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 177.36 30.18 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.906 -0.588 . . . . 1.99 110.725 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 846' ' ' GLU . . . . . 0.621 ' HB3' HD23 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -96.0 142.16 28.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 2.2999999999999998 111.292 -179.602 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -136.49 -4.77 2.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.014 -0.539 . . . . 1.98 110.658 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.51 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 58.3 m-85 -91.33 136.26 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.957 -0.565 . . . . 1.0900000000000001 110.905 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.716 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -128.91 124.0 34.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.73999999999999999 111.122 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -85.46 169.14 13.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.075 -0.511 . . . . 1.52 110.851 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.706 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.0 OUTLIER . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.434 -0.348 . . . . 1.04 111.51 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.789 0.328 . . . . 1.22 111.038 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.817 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.46 95.44 1.12 Allowed 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.999 0.428 . . . . 0.93999999999999995 110.077 179.744 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -97.54 89.33 4.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.997 -0.547 . . . . 0.67000000000000004 111.0 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.27 137.51 32.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 1.5700000000000001 110.682 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.486 HD12 ' CE1' ' A' ' 848' ' ' PHE . 0.6 OUTLIER -62.61 107.49 0.96 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.114 0.483 . . . . 0.81000000000000005 110.45 179.849 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.427 ' HB ' ' O ' ' A' ' 847' ' ' LYS . 17.6 t -96.29 136.04 28.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.497 -0.774 . . . . 1.1799999999999999 110.712 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -97.3 165.32 12.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 1.3999999999999999 110.969 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.01 51.1 2.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.069 -0.514 . . . . 2.8500000000000001 110.651 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 1.5 p -164.53 -28.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.882 -0.599 . . . . 0.33000000000000002 110.605 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 26.4 m0 -47.75 130.83 14.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.608 -0.724 . . . . 0.29999999999999999 112.035 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.82 168.28 10.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.831 -0.803 . . . . 1.8899999999999999 108.831 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -53.34 -24.14 11.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.005 0.431 . . . . 0.63 110.329 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.65 ' O ' ' HG3' ' A' ' 796' ' ' MET . 17.5 m-20 -76.85 -60.61 2.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.846 -0.615 . . . . 2.0499999999999998 109.66 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -55.14 -21.83 14.64 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-O 121.093 0.473 . . . . 1.0700000000000001 109.804 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.595 HD22 ' CE2' ' A' ' 834' ' ' TRP . 40.2 tp -73.81 -60.24 2.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.535 -0.757 . . . . 0.93000000000000005 110.365 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.672 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 19.0 mm -57.1 -36.65 52.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.394 -0.821 . . . . 0.32000000000000001 111.988 -179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.65 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.2 mtt -69.59 -39.44 77.3 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.68 0.276 . . . . 1.53 110.837 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -65.34 -50.77 64.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.211 0.529 . . . . 0.38 110.05 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.551 ' O ' HG23 ' A' ' 802' ' ' ILE . 31.0 mt -61.4 -48.26 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 115.495 -0.775 . . . . 0.5 110.349 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.672 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.9 OUTLIER -56.35 -34.79 66.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.765 -0.652 . . . . 0.81000000000000005 110.952 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.96 -24.07 60.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.266 -0.425 . . . . 0.97999999999999998 110.715 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 801' ' ' LYS . . . . . 0.583 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -99.29 -2.21 37.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.075 -0.511 . . . . 2.25 111.419 -179.887 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.578 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.3 pp -116.13 -22.91 4.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.718 0.294 . . . . 0.75 111.533 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 55.7 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.344 -0.389 . . . . 1.53 110.9 -179.804 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo . . . . . 0 C--O 1.232 0.191 0 CA-C-O 120.771 0.238 . . . . 0.94999999999999996 112.395 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.548 HG12 HD13 ' A' ' 802' ' ' ILE . 5.5 pt -146.55 171.32 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.276 -0.42 . . . . 1.9399999999999999 111.07 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 19.4 p -128.82 -67.3 0.79 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.193 -0.458 . . . . 1.1599999999999999 111.129 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.3 mptt -83.51 137.84 33.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 2.6899999999999999 110.736 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -152.03 -178.18 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.296 -0.411 . . . . 0.83999999999999997 111.603 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.501 ' HE2' HG13 ' A' ' 827' ' ' VAL . 6.8 mmtt -120.24 155.02 34.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.86 -0.609 . . . . 0.84999999999999998 110.691 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.62 ' CE1' HG23 ' A' ' 826' ' ' VAL . 5.2 p90 -136.47 174.29 10.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.468 -0.333 . . . . 0.70999999999999996 111.133 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -96.09 106.58 18.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.213 -0.449 . . . . 1.9099999999999999 111.043 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.444 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 5.7 t70 -79.31 173.3 12.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.8 -0.637 . . . . 1.8 110.938 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -79.21 33.55 0.23 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.224 -0.444 . . . . 1.6200000000000001 111.19 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -128.85 8.88 5.77 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.225 -0.443 . . . . 1.6499999999999999 110.554 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 64.22 51.89 48.93 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.86 -0.686 . . . . 0.88 112.414 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -176.03 141.13 0.44 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.146 0.498 . . . . 1.8600000000000001 110.598 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.547 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 58.9 m-85 -66.73 145.25 55.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.636 -0.711 . . . . 0.64000000000000001 110.747 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.62 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.9 OUTLIER -138.51 178.1 4.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 0.96999999999999997 110.824 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 827' ' ' VAL . . . . . 0.501 HG13 ' HE2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -99.1 116.46 42.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.0 0.428 . . . . 0.56000000000000005 111.326 -179.736 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 4.3 tp -82.33 108.17 15.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.8 -0.636 . . . . 0.81000000000000005 110.876 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -58.09 -69.38 1.3 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.863 -0.684 . . . . 0.81000000000000005 112.691 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 830' ' ' SER . . . . . 0.471 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 3.0 p -170.07 -143.42 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 110.497 -0.186 . . . . 1.3100000000000001 110.497 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.471 ' H ' ' HB2' ' A' ' 830' ' ' SER . 20.2 t70 -56.48 -19.17 14.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.716 0.293 . . . . 2.2000000000000002 110.831 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -70.47 -68.49 0.42 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.356 -0.384 . . . . 2.21 110.552 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.33 -12.22 28.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.399 -0.364 . . . . 0.72999999999999998 110.357 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.595 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.0 OUTLIER -82.68 -44.41 15.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.061 -0.518 . . . . 0.26000000000000001 110.363 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -35.25 80.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.049 -0.523 . . . . 1.98 109.947 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.11 -54.6 14.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.546 -0.752 . . . . 0.67000000000000004 110.079 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.82 -26.52 46.84 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.095 -0.502 . . . . 0.22 110.506 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 838' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -67.42 -50.13 60.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.075 -0.511 . . . . 0.84999999999999998 110.277 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -58.64 -24.5 61.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.938 -0.574 . . . . 1.95 110.136 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 6.7 ttp -74.86 -36.4 62.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.691 -0.686 . . . . 0.29999999999999999 110.444 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 17.0 mt -60.7 -43.23 98.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.082 -0.508 . . . . 0.46999999999999997 110.433 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.43 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -74.3 -27.39 60.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.545 . . . . 0.48999999999999999 111.181 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.35 7.63 0.99 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.048 -0.524 . . . . 1.6799999999999999 110.708 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 842' ' ' ALA . 24.1 m-80 -148.04 17.2 1.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.062 -0.517 . . . . 1.96 110.714 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.7 t30 60.22 12.59 3.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.17 -0.468 . . . . 1.99 110.872 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.16 171.01 15.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.973 -0.558 . . . . 2.2999999999999998 111.142 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 847' ' ' LYS . . . . . 0.427 ' O ' ' HB ' ' A' ' 785' ' ' VAL . 0.0 OUTLIER -152.21 -37.12 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.628 -0.714 . . . . 1.98 110.244 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.486 ' CE1' HD12 ' A' ' 784' ' ' LEU . 9.8 m-85 -83.49 147.14 27.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.019 -0.537 . . . . 1.0900000000000001 110.783 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.6 OUTLIER -123.38 132.63 54.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.219 -0.446 . . . . 0.73999999999999999 111.026 179.74 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 29.4 m-20 -85.65 154.15 21.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 1.52 110.936 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.817 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.331 -0.214 0 CA-C-N 116.21 -0.45 . . . . 1.04 111.047 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.636 0.255 . . . . 1.22 111.097 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.881 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.79 99.58 2.01 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 109.097 -0.705 . . . . 0.93999999999999995 109.097 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.591 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -96.46 94.87 7.65 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.723 -0.671 . . . . 0.67000000000000004 110.945 -178.851 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.504 HD11 ' HB1' ' A' ' 797' ' ' ALA . 0.2 OUTLIER -100.23 104.84 16.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.521 -0.763 . . . . 1.5700000000000001 110.872 -179.755 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.44 114.08 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.105 -0.498 . . . . 0.81000000000000005 110.567 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.482 HG11 ' CH2' ' A' ' 834' ' ' TRP . 30.7 m -103.41 179.55 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.451 -0.795 . . . . 1.1799999999999999 111.434 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.5 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 5.1 tp10 -122.97 176.7 5.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.968 -0.56 . . . . 1.3999999999999999 110.842 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 787' ' ' LYS . . . . . 0.5 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 2.5 mttt -90.0 54.96 2.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 2.8500000000000001 110.751 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.4 p -171.44 -27.97 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.107 -0.497 . . . . 0.33000000000000002 111.058 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -50.33 126.13 14.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.816 -0.629 . . . . 0.29999999999999999 112.086 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.89 167.93 11.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.708 -0.849 . . . . 1.8899999999999999 108.708 178.026 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.465 ' O ' HG12 ' A' ' 795' ' ' ILE . 87.4 t80 -54.51 -27.15 36.11 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.659 -0.416 . . . . 0.63 110.179 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.58 ' O ' ' HG3' ' A' ' 796' ' ' MET . 30.4 m-20 -70.71 -56.49 6.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.008 -0.542 . . . . 2.0499999999999998 109.622 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.96 -31.09 66.53 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.138 -0.483 . . . . 1.0700000000000001 110.279 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.608 HD22 ' CE2' ' A' ' 834' ' ' TRP . 31.7 tp -65.86 -54.48 26.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.826 -0.625 . . . . 0.93000000000000005 110.468 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.667 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 26.8 mm -54.11 -29.89 19.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.499 -0.773 . . . . 0.32000000000000001 111.744 -179.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.58 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.8 mtp -69.03 -51.59 37.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.558 0.218 . . . . 1.53 110.623 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 797' ' ' ALA . . . . . 0.504 ' HB1' HD11 ' A' ' 783' ' ' LEU . . . -54.27 -50.85 66.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.072 0.463 . . . . 0.38 110.157 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 802' ' ' ILE . 63.6 mt -60.3 -53.37 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.63 -0.714 . . . . 0.5 110.556 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.755 ' HA ' HG12 ' A' ' 802' ' ' ILE . 5.8 t-20 -54.33 -27.24 34.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.482 -0.781 . . . . 0.81000000000000005 111.458 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.11 -29.18 48.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.438 -0.346 . . . . 0.97999999999999998 111.099 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 801' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 801' ' ' LYS . 0.2 OUTLIER -93.14 -9.29 39.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.397 -0.365 . . . . 2.25 111.488 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.755 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.0 OUTLIER -100.75 -31.0 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.825 0.345 . . . . 0.75 111.278 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 803' ' ' SER . . . . . 0.483 ' N ' HG13 ' A' ' 802' ' ' ILE . 69.0 p . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.272 -0.422 . . . . 1.53 110.817 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo . . . . . 0 CA--C 1.527 0.133 0 CA-C-O 120.925 0.302 . . . . 0.94999999999999996 112.392 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.619 HG12 HD13 ' A' ' 802' ' ' ILE . 5.5 mm -119.6 161.78 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.038 -0.528 . . . . 1.9399999999999999 110.822 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 814' ' ' THR . . . . . 0.582 HG23 ' H ' ' A' ' 815' ' ' LYS . 0.0 OUTLIER -131.26 -62.23 0.89 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.54 -0.3 . . . . 1.1599999999999999 111.414 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 815' ' ' LYS . . . . . 0.582 ' H ' HG23 ' A' ' 814' ' ' THR . 0.0 OUTLIER -82.13 142.41 32.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.37 -0.377 . . . . 2.6899999999999999 110.869 -179.835 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -155.59 167.93 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.066 -0.516 . . . . 0.83999999999999997 111.267 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.458 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 19.2 mmtt -105.41 149.6 25.99 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.99 -0.55 . . . . 0.84999999999999998 110.572 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.641 ' CE1' HG23 ' A' ' 826' ' ' VAL . 6.2 p90 -131.13 169.3 16.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.764 0.316 . . . . 0.70999999999999996 111.356 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -92.14 107.08 18.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.071 -0.513 . . . . 1.9099999999999999 110.884 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.409 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 13.4 t70 -79.0 173.91 12.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.737 -0.665 . . . . 1.8 110.964 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 821' ' ' GLU . . . . . 0.605 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 12.4 pt-20 -71.02 0.92 6.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.244 -0.434 . . . . 1.6200000000000001 111.439 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.61 13.79 32.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.399 -0.364 . . . . 1.6499999999999999 110.796 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 55.58 55.22 29.81 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.812 -0.708 . . . . 0.88 112.277 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -171.93 135.37 0.82 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.006 0.432 . . . . 1.8600000000000001 110.553 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.583 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 65.3 m-85 -63.67 131.43 47.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.879 -0.6 . . . . 0.64000000000000001 110.895 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.641 HG23 ' CE1' ' A' ' 818' ' ' TYR . 1.8 m -127.63 -179.07 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.234 -0.439 . . . . 0.96999999999999997 110.789 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 2.5 t -98.75 116.94 42.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.054 0.454 . . . . 0.56000000000000005 111.295 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.71 108.0 12.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.81000000000000005 110.689 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -56.8 -67.13 2.38 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.829 -0.7 . . . . 0.81000000000000005 112.692 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 830' ' ' SER . . . . . 0.428 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -173.86 -137.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.421 -0.214 . . . . 1.3100000000000001 110.421 -179.791 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.431 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 28.3 t70 -59.88 -16.19 27.26 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.745 0.307 . . . . 2.2000000000000002 110.751 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.41 -69.43 0.4 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 2.21 110.854 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.91 -12.46 25.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.72999999999999998 110.519 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.608 ' CE2' HD22 ' A' ' 794' ' ' LEU . 3.4 t-105 -84.68 -39.67 18.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.277 -0.42 . . . . 0.26000000000000001 110.189 179.203 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.748 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -70.28 -33.48 71.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 1.98 109.836 179.011 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 66.6 t -74.84 -55.9 10.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.476 -0.784 . . . . 0.67000000000000004 110.203 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -56.12 -27.27 53.32 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.211 -0.449 . . . . 0.22 110.413 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.748 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 25.5 mtmt -66.44 -51.38 57.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.005 -0.543 . . . . 0.84999999999999998 110.359 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.69 -28.22 68.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 1.95 110.178 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 840' ' ' MET . . . . . 0.605 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 11.9 ttp -70.74 -36.71 73.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.715 -0.675 . . . . 0.29999999999999999 110.216 179.383 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.9 HD11 HD23 ' A' ' 849' ' ' LEU . 49.4 mt -67.04 -42.76 84.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.865 -0.607 . . . . 0.46999999999999997 110.914 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.431 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -72.01 -24.9 61.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.48999999999999999 111.235 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.04 6.11 1.01 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.309 -0.405 . . . . 1.6799999999999999 110.756 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 842' ' ' ALA . 65.1 m-80 -150.86 21.1 0.79 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.087 -0.506 . . . . 1.96 110.851 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.3 15.1 4.05 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.036 -0.529 . . . . 1.99 111.167 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.08 170.58 16.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.919 0.39 . . . . 2.2999999999999998 110.924 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -157.68 -22.28 0.09 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.92 -0.582 . . . . 1.98 111.272 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.591 ' HB3' HG22 ' A' ' 782' ' ' THR . 32.4 m-85 -86.4 122.49 30.43 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.841 0.353 . . . . 1.0900000000000001 111.174 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.9 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -105.86 121.45 44.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.014 -0.539 . . . . 0.73999999999999999 110.488 179.688 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.46 ' C ' HG13 ' A' ' 851' ' ' ILE . 46.3 m-80 -76.82 141.27 40.75 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.457 -0.338 . . . . 1.52 111.394 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.881 HD12 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-N 116.194 -0.457 . . . . 1.04 111.421 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.565 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 1.5 mt . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.749 0.309 . . . . 1.22 111.054 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 1.056 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -142.61 86.04 1.93 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.704 -0.48 . . . . 0.93999999999999995 109.704 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.571 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 2.1 m -97.76 118.76 35.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.82 -0.627 . . . . 0.67000000000000004 111.33 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.536 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -129.65 -168.3 1.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.731 -0.668 . . . . 1.5700000000000001 111.031 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 784' ' ' LEU . 0.0 OUTLIER -108.05 119.92 40.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.685 -0.688 . . . . 0.81000000000000005 109.472 178.799 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.569 HG13 ' CE3' ' A' ' 789' ' ' TRP . 89.1 t -117.69 145.19 23.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.227 -0.442 . . . . 1.1799999999999999 111.623 -178.648 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 4.7 tp10 -95.15 168.31 10.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.939 -0.573 . . . . 1.3999999999999999 110.742 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 787' ' ' LYS . . . . . 0.411 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -85.25 16.52 3.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 2.8500000000000001 110.993 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.09 -26.18 2.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.955 -0.566 . . . . 0.33000000000000002 111.117 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 789' ' ' TRP . . . . . 0.569 ' CE3' HG13 ' A' ' 785' ' ' VAL . 39.2 m0 -52.85 120.36 5.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.067 -0.515 . . . . 0.29999999999999999 112.103 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 790' ' ' ASN . . . . . 0.719 ' ND2' ' H ' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -94.05 160.4 14.73 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.54 -0.911 . . . . 1.8899999999999999 108.54 178.017 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.427 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 78.3 t80 -44.48 -34.86 2.22 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.542 0.21 . . . . 0.63 111.245 -178.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.719 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 33.8 t70 -68.62 -51.28 44.01 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.855 -0.424 . . . . 2.0499999999999998 109.855 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.23 -31.73 71.52 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.176 -0.466 . . . . 1.0700000000000001 110.32 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.569 HD22 ' CE2' ' A' ' 834' ' ' TRP . 29.8 tp -65.15 -52.98 51.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.648 -0.705 . . . . 0.93000000000000005 110.198 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.693 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 31.0 mm -54.36 -28.85 19.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.535 -0.757 . . . . 0.32000000000000001 111.212 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.609 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 6.1 mtp -67.35 -50.36 60.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.688 0.28 . . . . 1.53 110.443 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -55.06 -54.34 44.29 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.067 0.46 . . . . 0.38 110.144 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 65.4 mt -56.73 -51.01 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-N 115.765 -0.652 . . . . 0.5 110.394 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.693 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -56.48 -26.66 54.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.536 -0.756 . . . . 0.81000000000000005 111.319 -179.764 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.75 -24.64 41.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.372 -0.376 . . . . 0.97999999999999998 111.194 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 801' ' ' LYS . . . . . 0.452 ' HB3' ' CE2' ' A' ' 781' ' ' PHE . 1.2 mptt -100.02 -6.78 25.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 2.25 111.334 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.592 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.4 pp -109.05 -32.45 2.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.771 0.32 . . . . 0.75 111.412 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 803' ' ' SER . . . . . 0.563 ' HB2' HD12 ' A' ' 802' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--N 1.332 -0.191 0 CA-C-N 116.383 -0.371 . . . . 1.53 111.088 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo . . . . . 0 C--O 1.232 0.183 0 CA-C-O 120.741 0.225 . . . . 0.94999999999999996 112.215 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.452 HD12 HG22 ' A' ' 816' ' ' ILE . 9.4 pt -140.18 162.68 24.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.344 -0.389 . . . . 1.9399999999999999 111.155 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 5.8 p -129.09 -43.36 1.33 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.182 -0.463 . . . . 1.1599999999999999 111.156 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.94 114.99 22.08 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.258 -0.428 . . . . 2.6899999999999999 110.925 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 816' ' ' ILE . . . . . 0.579 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -135.75 176.18 8.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.267 -0.424 . . . . 0.83999999999999997 111.443 -179.847 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.525 ' HE2' HG22 ' A' ' 827' ' ' VAL . 12.3 mmtt -128.16 136.39 51.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.959 -0.564 . . . . 0.84999999999999998 110.403 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.616 ' CE1' HG23 ' A' ' 826' ' ' VAL . 3.7 p90 -116.35 177.99 4.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.92 0.391 . . . . 0.70999999999999996 111.421 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 819' ' ' GLN . . . . . 0.481 HE21 ' HA2' ' A' ' 823' ' ' GLY . 11.2 tp60 -100.1 111.3 23.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.001 -0.545 . . . . 1.9099999999999999 110.741 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.443 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 6.5 t70 -79.37 175.17 10.84 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.681 -0.691 . . . . 1.8 110.953 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.37 40.19 0.56 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.252 -0.431 . . . . 1.6200000000000001 111.09 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -140.28 15.7 2.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.342 -0.39 . . . . 1.6499999999999999 110.781 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 823' ' ' GLY . . . . . 0.481 ' HA2' HE21 ' A' ' 819' ' ' GLN . . . 58.3 54.13 40.15 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.81 -0.71 . . . . 0.88 112.23 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -172.75 133.51 0.58 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.925 0.393 . . . . 1.8600000000000001 110.658 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.534 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 67.0 m-85 -66.37 142.77 57.5 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.013 -0.54 . . . . 0.64000000000000001 110.704 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.616 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.3 OUTLIER -133.42 172.34 16.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 0.96999999999999997 110.714 179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 827' ' ' VAL . . . . . 0.525 HG22 ' HE2' ' A' ' 817' ' ' LYS . 1.8 t -98.78 113.07 32.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 0.56000000000000005 111.153 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.68 116.93 20.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.747 -0.661 . . . . 0.81000000000000005 110.896 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -65.72 -64.25 3.55 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.866 -0.683 . . . . 0.81000000000000005 112.615 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.36 -142.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.533 0.206 . . . . 1.3100000000000001 110.629 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.552 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 11.1 t70 -57.08 -15.1 4.6 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.724 0.297 . . . . 2.2000000000000002 111.168 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.468 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.0 OUTLIER -73.44 -73.62 0.21 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.438 -0.347 . . . . 2.21 111.021 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -12.49 10.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.396 -0.366 . . . . 0.72999999999999998 110.646 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.569 ' CE2' HD22 ' A' ' 794' ' ' LEU . 3.7 t-105 -85.36 -39.85 17.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.385 -0.371 . . . . 0.26000000000000001 110.145 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.736 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -69.43 -35.42 75.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.133 0.492 . . . . 1.98 109.879 178.959 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 832' ' ' GLU . 25.2 t -73.46 -55.19 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.625 -0.716 . . . . 0.67000000000000004 110.071 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.8 -27.64 52.2 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.058 -0.519 . . . . 0.22 110.374 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.736 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.3 mtmt -66.92 -47.92 70.26 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.972 -0.558 . . . . 0.84999999999999998 110.22 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -62.64 -32.64 73.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.042 -0.526 . . . . 1.95 109.946 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -64.63 -31.32 72.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.732 -0.667 . . . . 0.29999999999999999 110.119 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.89 HD11 HD23 ' A' ' 849' ' ' LEU . 1.5 mt -72.02 -42.69 66.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.788 -0.642 . . . . 0.46999999999999997 110.814 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.422 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -69.25 -20.52 63.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.463 . . . . 0.48999999999999999 111.197 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -68.07 3.61 1.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.489 . . . . 1.6799999999999999 110.577 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.12 20.06 0.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 1.96 110.901 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 58.62 19.08 6.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 1.99 111.006 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 846' ' ' GLU . . . . . 0.728 ' HB3' HD23 ' A' ' 841' ' ' LEU . 2.3 mt-10 -71.59 143.03 49.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 2.2999999999999998 110.816 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 847' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' A' ' 784' ' ' LEU . 27.4 mttt -136.09 14.59 3.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 1.98 110.751 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.536 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 19.6 m-85 -119.49 128.62 54.14 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.139 -0.482 . . . . 1.0900000000000001 111.251 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.89 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -115.46 129.06 56.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.005 -0.543 . . . . 0.73999999999999999 110.724 179.821 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.447 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 3.2 m120 -94.81 142.32 27.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.089 -0.505 . . . . 1.52 111.183 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 1.056 HD12 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.333 -0.13 0 CA-C-N 116.52 -0.309 . . . . 1.04 111.235 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.444 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.705 0.288 . . . . 1.22 111.097 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.452 ' CB ' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -139.83 82.91 1.9 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.043 0.449 . . . . 0.93999999999999995 109.805 179.665 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.86 121.65 40.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.867 -0.606 . . . . 0.67000000000000004 111.458 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -112.58 -163.67 0.87 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.651 -0.704 . . . . 1.5700000000000001 110.629 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.414 HD12 ' HG3' ' A' ' 847' ' ' LYS . 0.3 OUTLIER -124.97 101.89 7.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.161 -0.472 . . . . 0.81000000000000005 110.341 179.503 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 31.4 m -93.36 165.13 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.985 -0.552 . . . . 1.1799999999999999 111.341 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.45 ' HG3' ' HE3' ' A' ' 787' ' ' LYS . 0.9 OUTLIER -116.99 175.57 5.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 1.3999999999999999 111.028 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 787' ' ' LYS . . . . . 0.45 ' HE3' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -89.17 54.89 3.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.181 0.515 . . . . 2.8500000000000001 110.735 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -168.31 -26.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.649 -0.705 . . . . 0.33000000000000002 110.587 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 27.3 m0 -52.08 126.11 17.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.693 -0.685 . . . . 0.29999999999999999 111.923 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.25 165.86 12.18 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.944 -0.761 . . . . 1.8899999999999999 108.944 178.314 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.401 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 92.0 t80 -51.42 -24.9 5.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.901 0.381 . . . . 0.63 110.297 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.64 ' O ' ' HG3' ' A' ' 796' ' ' MET . 1.5 m-20 -70.5 -62.89 1.22 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.017 -0.538 . . . . 2.0499999999999998 109.74 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.34 -29.26 33.17 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.112 0.482 . . . . 1.0700000000000001 110.336 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.576 HD22 ' CE2' ' A' ' 834' ' ' TRP . 26.5 tp -67.96 -53.61 24.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.784 -0.644 . . . . 0.93000000000000005 110.235 179.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.642 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 21.9 mm -60.09 -30.9 46.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.599 -0.728 . . . . 0.32000000000000001 111.211 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.64 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 21.3 mtp -69.13 -51.79 34.82 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.339 -0.245 . . . . 1.53 110.339 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.32 -52.01 62.88 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.014 0.435 . . . . 0.38 110.067 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.501 ' O ' HG23 ' A' ' 802' ' ' ILE . 71.5 mt -58.53 -52.48 59.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.636 -0.711 . . . . 0.5 110.423 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.651 ' HA ' HG12 ' A' ' 802' ' ' ILE . 7.0 t-20 -56.64 -21.59 28.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.614 -0.721 . . . . 0.81000000000000005 111.215 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 22.3 t -79.29 -31.42 43.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.97999999999999998 110.618 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -94.91 -8.63 36.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.96 -0.564 . . . . 2.25 111.245 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.651 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.3 pt -111.03 -23.94 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.476 -0.329 . . . . 0.75 111.36 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 803' ' ' SER . . . . . 0.476 ' N ' HG13 ' A' ' 802' ' ' ILE . 3.8 t . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 1.53 110.928 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo . . . . . 0 N--CA 1.465 -0.154 0 CA-C-O 120.834 0.264 . . . . 0.94999999999999996 112.427 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.512 HG12 HD13 ' A' ' 802' ' ' ILE . 35.0 pt -135.77 174.34 12.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.022 -0.535 . . . . 1.9399999999999999 111.046 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 814' ' ' THR . . . . . 0.566 HG23 ' H ' ' A' ' 815' ' ' LYS . 0.0 OUTLIER -146.4 -60.75 0.31 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.238 -0.437 . . . . 1.1599999999999999 111.057 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 815' ' ' LYS . . . . . 0.566 ' H ' HG23 ' A' ' 814' ' ' THR . 1.5 tttp -92.44 126.81 37.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.293 -0.412 . . . . 2.6899999999999999 110.464 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -154.09 179.17 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.83999999999999997 111.564 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -109.42 -178.35 3.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.84999999999999998 110.215 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.468 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 15.3 p90 -156.38 164.11 38.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.716 0.293 . . . . 0.70999999999999996 111.048 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 819' ' ' GLN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.7 OUTLIER -83.53 103.16 12.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.114 0.483 . . . . 1.9099999999999999 110.605 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -79.6 176.31 9.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.638 -0.71 . . . . 1.8 110.982 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 821' ' ' GLU . . . . . 0.475 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.2 OUTLIER -82.93 27.53 0.54 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 1.6200000000000001 110.954 179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.39 -0.52 14.47 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.239 -0.437 . . . . 1.6499999999999999 110.775 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 84.12 16.69 66.63 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.767 -0.73 . . . . 0.88 112.436 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -143.72 -145.41 0.17 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.743 0.306 . . . . 1.8600000000000001 110.561 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.468 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 97.4 m-85 -129.95 145.95 51.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.965 0.412 . . . . 0.64000000000000001 111.602 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.473 ' CG1' ' N ' ' A' ' 827' ' ' VAL . 10.0 t -122.55 163.99 20.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.645 -0.707 . . . . 0.96999999999999997 109.722 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 827' ' ' VAL . . . . . 0.473 ' N ' ' CG1' ' A' ' 826' ' ' VAL . 0.2 OUTLIER -97.65 107.52 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.065 0.459 . . . . 0.56000000000000005 111.296 -179.453 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.404 ' HG ' ' HB3' ' A' ' 833' ' ' ASP . 5.6 tt -79.6 136.8 36.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.652 -0.704 . . . . 0.81000000000000005 110.723 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -90.88 -59.39 1.41 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.654 -0.784 . . . . 0.81000000000000005 112.495 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -170.5 -141.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.358 -0.238 . . . . 1.3100000000000001 110.358 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -55.96 -23.52 32.69 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.666 0.27 . . . . 2.2000000000000002 110.896 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.585 ' O ' HG23 ' A' ' 836' ' ' VAL . 5.8 tt0 -64.88 -73.74 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.294 -0.412 . . . . 2.21 110.806 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 833' ' ' ASP . . . . . 0.404 ' HB3' ' HG ' ' A' ' 828' ' ' LEU . 0.4 OUTLIER -60.2 -12.59 9.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.301 -0.409 . . . . 0.72999999999999998 110.636 179.63 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.576 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.5 t-105 -81.37 -39.65 24.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.983 0.42 . . . . 0.26000000000000001 109.961 179.013 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -73.55 -28.87 62.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.999 -0.546 . . . . 1.98 109.68 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 832' ' ' GLU . 24.4 t -75.48 -53.99 14.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.585 -0.734 . . . . 0.67000000000000004 109.706 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.81 -29.63 65.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.661 -0.7 . . . . 0.22 110.457 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 838' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -67.46 -45.43 75.99 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.051 -0.522 . . . . 0.84999999999999998 110.518 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -61.76 -25.23 67.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.001 -0.545 . . . . 1.95 110.326 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 840' ' ' MET . . . . . 0.475 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 18.1 ttp -75.67 -38.44 58.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.68 -0.691 . . . . 0.29999999999999999 110.418 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.686 HD11 HD23 ' A' ' 849' ' ' LEU . 12.1 mt -62.76 -53.2 57.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.044 -0.526 . . . . 0.46999999999999997 110.806 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.424 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -62.53 -22.51 66.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.48999999999999999 111.039 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -67.7 3.37 1.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.077 -0.51 . . . . 1.6799999999999999 110.661 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.454 ' HB2' ' OE2' ' A' ' 846' ' ' GLU . 0.0 OUTLIER -154.98 22.57 0.44 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.465 . . . . 1.96 110.935 -180.0 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.7 m120 58.09 19.67 6.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.1 -0.5 . . . . 1.99 111.208 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 846' ' ' GLU . . . . . 0.454 ' OE2' ' HB2' ' A' ' 844' ' ' ASN . 0.1 OUTLIER -82.0 148.48 28.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.296 -0.411 . . . . 2.2999999999999998 110.635 179.803 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 847' ' ' LYS . . . . . 0.414 ' HG3' HD12 ' A' ' 784' ' ' LEU . 0.2 OUTLIER -141.68 11.04 2.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 1.98 110.97 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.455 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 64.9 m-85 -107.18 126.3 52.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.118 -0.492 . . . . 1.0900000000000001 110.733 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.686 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -123.68 126.56 46.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.232 -0.44 . . . . 0.73999999999999999 111.09 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 21.2 m-20 -88.12 -176.3 5.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.051 -0.522 . . . . 1.52 110.732 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.452 HG13 ' CB ' ' A' ' 781' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.24 0 CA-C-O 120.811 0.339 . . . . 1.04 111.599 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.528 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.822 0.344 . . . . 1.22 111.151 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.506 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.13 92.32 1.42 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.128 0.49 . . . . 0.93999999999999995 110.025 179.617 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.4 96.3 8.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.818 -0.628 . . . . 0.67000000000000004 110.729 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.532 HD11 ' HG3' ' A' ' 801' ' ' LYS . 0.3 OUTLIER -99.38 132.14 44.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.674 -0.694 . . . . 1.5700000000000001 111.128 -179.365 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.551 HD12 ' HE1' ' A' ' 848' ' ' PHE . 8.5 tt -65.87 107.01 1.69 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.092 -0.504 . . . . 0.81000000000000005 110.392 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.426 HG11 ' CH2' ' A' ' 834' ' ' TRP . 28.3 m -102.01 173.92 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.521 . . . . 1.1799999999999999 111.357 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.435 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 0.7 OUTLIER -119.4 170.33 9.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 1.3999999999999999 110.833 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 787' ' ' LYS . . . . . 0.435 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -83.46 14.86 3.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 2.8500000000000001 111.026 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 788' ' ' VAL . . . . . 0.434 HG12 ' HG2' ' A' ' 786' ' ' GLU . 1.6 p -127.35 -27.44 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.922 -0.581 . . . . 0.33000000000000002 110.909 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -47.92 125.11 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.922 -0.581 . . . . 0.29999999999999999 112.007 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.74 165.93 12.46 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.134 -0.691 . . . . 1.8899999999999999 109.134 178.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -50.98 -26.42 5.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.023 0.439 . . . . 0.63 110.213 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.643 ' O ' ' HG3' ' A' ' 796' ' ' MET . 14.0 t70 -71.89 -61.41 1.8 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.863 -0.608 . . . . 2.0499999999999998 109.577 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -53.79 -24.12 14.27 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.07 -0.514 . . . . 1.0700000000000001 110.128 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.631 HD22 ' CE2' ' A' ' 834' ' ' TRP . 32.5 tp -73.56 -57.34 4.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 0.93000000000000005 110.497 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.696 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.2 mm -58.0 -33.7 46.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.689 -0.687 . . . . 0.32000000000000001 111.901 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.643 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 3.3 mtp -72.32 -44.42 62.7 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.107 -0.237 . . . . 1.53 111.001 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -61.78 -47.29 85.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.167 0.508 . . . . 0.38 109.738 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.453 ' O ' HG23 ' A' ' 802' ' ' ILE . 17.5 mt -63.39 -49.64 81.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.478 -0.783 . . . . 0.5 110.126 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.696 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.6 OUTLIER -57.77 -23.76 53.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.838 -0.619 . . . . 0.81000000000000005 110.909 179.568 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.19 -27.74 38.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.97999999999999998 110.6 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 801' ' ' LYS . . . . . 0.532 ' HG3' HD11 ' A' ' 783' ' ' LEU . 8.1 mmpt? -97.82 -4.18 37.31 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.052 -0.522 . . . . 2.25 111.394 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.2 pp -113.8 -31.16 2.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.7 0.286 . . . . 0.75 111.422 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 803' ' ' SER . . . . . 0.402 ' N ' HG13 ' A' ' 802' ' ' ILE . 1.2 m . . . . . 0 C--N 1.33 -0.242 0 CA-C-O 120.926 0.393 . . . . 1.53 111.139 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 812' ' ' PRO . . . . . 0.551 ' HB2' HD21 ' A' ' 799' ' ' ASN . 53.7 Cg_endo . . . . . 0 C--O 1.232 0.202 0 CA-C-O 120.844 0.269 . . . . 0.94999999999999996 112.53 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.496 HG12 HD13 ' A' ' 802' ' ' ILE . 3.4 pt -145.0 163.57 13.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.162 -0.472 . . . . 1.9399999999999999 111.1 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 1.2 p -133.16 -63.01 0.78 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.313 -0.403 . . . . 1.1599999999999999 111.275 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -82.14 126.11 31.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 2.6899999999999999 110.96 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -153.53 174.88 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.83999999999999997 111.212 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.453 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 15.0 mttt -115.37 152.99 31.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.84999999999999998 110.81 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.43 ' CE2' ' HB2' ' A' ' 828' ' ' LEU . 6.9 p90 -129.35 179.26 5.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.379 -0.373 . . . . 0.70999999999999996 110.898 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 819' ' ' GLN . . . . . 0.529 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -92.86 115.7 28.36 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.461 0.648 . . . . 1.9099999999999999 110.748 179.906 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -93.18 177.45 6.05 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 114.859 -1.064 . . . . 1.8 111.132 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -78.92 13.31 1.78 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.103 -0.499 . . . . 1.6200000000000001 111.113 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.48 4.7 46.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.427 . . . . 1.6499999999999999 110.628 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 75.72 10.48 84.85 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.914 -0.66 . . . . 0.88 112.475 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.64 -149.85 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.752 0.31 . . . . 1.8600000000000001 110.472 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.41 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 48.5 m-85 -128.41 139.75 52.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.384 -0.371 . . . . 0.64000000000000001 110.913 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.453 ' C ' ' HD3' ' A' ' 817' ' ' LYS . 8.9 m -123.39 173.15 9.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.419 -0.355 . . . . 0.96999999999999997 110.745 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -98.75 123.53 51.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.036 0.446 . . . . 0.56000000000000005 111.492 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 834' ' ' TRP . 5.3 tp -81.76 109.73 16.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.81000000000000005 110.723 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -64.5 -60.72 6.7 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.811 -0.709 . . . . 0.81000000000000005 112.644 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 830' ' ' SER . . . . . 0.446 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -171.23 -142.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.476 -0.194 . . . . 1.3100000000000001 110.476 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.446 ' H ' ' HB3' ' A' ' 830' ' ' SER . 6.0 p-10 -61.67 -15.4 39.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.896 0.379 . . . . 2.2000000000000002 110.91 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.472 ' O ' HG23 ' A' ' 836' ' ' VAL . 44.4 mt-10 -73.72 -68.8 0.48 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.229 -0.441 . . . . 2.21 110.784 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.18 -13.52 18.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.308 -0.405 . . . . 0.72999999999999998 110.546 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.631 ' CE2' HD22 ' A' ' 794' ' ' LEU . 2.2 t-105 -81.72 -47.48 12.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.198 -0.455 . . . . 0.26000000000000001 110.037 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.31 -32.92 74.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.982 -0.554 . . . . 1.98 109.877 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 832' ' ' GLU . 58.9 t -74.04 -53.93 16.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.474 -0.785 . . . . 0.67000000000000004 109.97 179.232 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -53.39 -28.43 29.36 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.03 -0.532 . . . . 0.22 110.185 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.506 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 2.0 mtpp -67.73 -47.9 68.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.765 -0.652 . . . . 0.84999999999999998 110.366 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -60.17 -28.44 67.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.073 -0.512 . . . . 1.95 110.205 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 19.4 ttp -69.92 -39.44 76.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.825 -0.625 . . . . 0.29999999999999999 110.278 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.403 HD22 ' HB3' ' A' ' 846' ' ' GLU . 26.6 mt -66.59 -48.87 68.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.923 -0.58 . . . . 0.46999999999999997 110.705 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 842' ' ' ALA . . . . . . . . . . . . . . . -63.02 -23.47 67.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 0.48999999999999999 110.957 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.36 -0.81 2.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.039 -0.528 . . . . 1.6799999999999999 110.452 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 844' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.41 20.36 1.71 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.8 -0.637 . . . . 1.96 110.637 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.66 25.06 14.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.976 -0.556 . . . . 1.99 111.238 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 846' ' ' GLU . . . . . 0.403 ' HB3' HD22 ' A' ' 841' ' ' LEU . 2.1 mm-40 -85.48 171.85 11.46 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.48 -0.327 . . . . 2.2999999999999998 110.727 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 847' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 784' ' ' LEU . 15.3 pttt -159.85 11.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.31 -0.405 . . . . 1.98 111.414 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.551 ' HE1' HD12 ' A' ' 784' ' ' LEU . 29.4 m-85 -120.83 124.39 44.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.893 0.377 . . . . 1.0900000000000001 111.068 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.53 ' HG ' ' HZ3' ' A' ' 834' ' ' TRP . 0.7 OUTLIER -101.82 116.24 32.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.06 -0.518 . . . . 0.73999999999999999 110.178 179.55 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.529 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 7.2 m120 -72.16 162.69 29.11 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.058 -0.519 . . . . 1.52 111.302 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.528 ' O ' ' HA ' ' A' ' 780' ' ' ILE . 3.5 mm . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 116.208 -0.451 . . . . 1.04 111.029 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.427 ' HB ' ' OD1' ' A' ' 850' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.557 0.217 . . . . 1.22 111.029 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.752 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -144.37 87.15 1.86 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.089 0.471 . . . . 0.93999999999999995 110.078 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.455 HG23 ' OD1' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -98.19 91.69 5.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.655 -0.702 . . . . 0.67000000000000004 111.229 -179.336 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.17 144.61 26.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.804 -0.634 . . . . 1.5700000000000001 110.956 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.409 ' HB2' ' HE1' ' A' ' 848' ' ' PHE . 1.2 tt -85.01 114.45 22.18 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.252 -0.431 . . . . 0.81000000000000005 110.316 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.442 HG11 ' CH2' ' A' ' 834' ' ' TRP . 34.9 m -98.51 -173.69 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.92 -0.582 . . . . 1.1799999999999999 111.497 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.562 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 3.9 tp10 -133.86 167.92 19.69 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.952 -0.567 . . . . 1.3999999999999999 110.676 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 787' ' ' LYS . . . . . 0.562 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -82.8 49.52 1.51 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.253 -0.43 . . . . 2.8500000000000001 110.781 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -166.09 -25.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.138 -0.483 . . . . 0.33000000000000002 110.987 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -52.65 123.86 12.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.855 -0.612 . . . . 0.29999999999999999 111.922 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.23 168.76 11.11 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.804 -0.813 . . . . 1.8899999999999999 108.804 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.428 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 63.3 t80 -53.56 -26.11 20.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.139 0.495 . . . . 0.63 110.252 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.615 ' O ' ' HG3' ' A' ' 796' ' ' MET . 2.5 m-20 -70.18 -63.72 1.03 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.694 -0.685 . . . . 2.0499999999999998 109.766 178.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.97 -29.8 31.11 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.223 -0.444 . . . . 1.0700000000000001 110.323 179.311 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.591 HD22 ' CE2' ' A' ' 834' ' ' TRP . 30.2 tp -66.86 -54.32 23.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.824 -0.626 . . . . 0.93000000000000005 110.429 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.67 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.9 mm -59.52 -33.06 50.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.639 -0.709 . . . . 0.32000000000000001 111.621 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.615 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 4.7 mtt -68.28 -52.78 29.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.657 0.265 . . . . 1.53 110.499 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.42 -52.89 57.93 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.203 -0.453 . . . . 0.38 110.039 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.484 ' O ' HG12 ' A' ' 802' ' ' ILE . 93.4 mt -57.05 -52.39 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.757 -0.656 . . . . 0.5 110.583 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.683 ' HA ' HG12 ' A' ' 802' ' ' ILE . 1.1 t-20 -54.68 -29.82 53.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.502 -0.772 . . . . 0.81000000000000005 111.379 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 29.5 t -75.88 -26.25 56.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.468 -0.333 . . . . 0.97999999999999998 111.017 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -101.57 -0.43 34.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.273 -0.422 . . . . 2.25 111.566 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.683 HG12 ' HA ' ' A' ' 799' ' ' ASN . 14.0 pt -117.01 -26.38 2.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.681 0.276 . . . . 0.75 111.628 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 21.6 p . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 120.979 0.419 . . . . 1.53 111.124 -179.966 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 812' ' ' PRO . . . . . 0.5 ' HB2' HD21 ' A' ' 799' ' ' ASN . 68.9 Cg_endo . . . . . 0 C--O 1.231 0.167 0 CA-C-O 120.847 0.269 . . . . 0.94999999999999996 112.284 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.492 HG13 HD12 ' A' ' 802' ' ' ILE . 2.1 mt -128.52 151.48 35.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.095 -0.502 . . . . 1.9399999999999999 111.364 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.39 -71.44 0.74 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.021 -0.536 . . . . 1.1599999999999999 110.834 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -83.88 131.62 34.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 2.6899999999999999 110.592 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -151.61 -174.72 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.307 -0.406 . . . . 0.83999999999999997 111.448 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -116.21 175.38 5.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.567 . . . . 0.84999999999999998 110.173 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.63 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 22.7 p90 -148.44 166.28 28.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.921 0.391 . . . . 0.70999999999999996 111.112 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 819' ' ' GLN . . . . . 0.513 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 1.9 tp60 -96.39 108.45 20.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 1.9099999999999999 110.577 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.426 ' HB3' ' CG2' ' A' ' 826' ' ' VAL . 0.1 OUTLIER -79.12 -178.2 6.03 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.756 -0.657 . . . . 1.8 111.064 -179.834 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 821' ' ' GLU . . . . . 0.514 ' HG2' ' HG3' ' A' ' 840' ' ' MET . 3.2 pt-20 -87.2 33.99 0.68 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.277 -0.42 . . . . 1.6200000000000001 111.59 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -139.17 14.93 2.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.36 -0.382 . . . . 1.6499999999999999 110.735 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 59.84 59.13 11.05 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.842 -0.694 . . . . 0.88 112.237 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -169.36 132.59 1.28 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.965 0.412 . . . . 1.8600000000000001 110.493 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.583 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 49.4 m-85 -73.9 126.51 30.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 0.64000000000000001 111.018 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.63 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 1.3 t -108.27 170.62 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.903 -0.59 . . . . 0.96999999999999997 111.076 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 827' ' ' VAL . . . . . 0.501 ' H ' HG12 ' A' ' 826' ' ' VAL . 1.4 t -99.65 107.0 19.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.33 -0.396 . . . . 0.56000000000000005 111.197 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.89 110.19 18.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.53 . . . . 0.81000000000000005 110.736 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -62.42 -65.11 3.36 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.858 -0.686 . . . . 0.81000000000000005 112.605 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 85.1 p -170.2 -131.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.495 -0.187 . . . . 1.3100000000000001 110.495 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -62.8 -11.57 18.73 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.786 0.327 . . . . 2.2000000000000002 110.906 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -79.07 -68.95 0.61 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.236 -0.438 . . . . 2.21 110.954 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.85 -11.99 21.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.297 -0.41 . . . . 0.72999999999999998 110.568 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.591 ' CE2' HD22 ' A' ' 794' ' ' LEU . 0.9 OUTLIER -81.31 -45.2 16.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.309 -0.405 . . . . 0.26000000000000001 110.019 179.267 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.69 -36.18 80.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.958 -0.564 . . . . 1.98 109.957 178.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 87.9 t -70.2 -53.88 21.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.51 -0.768 . . . . 0.67000000000000004 110.06 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.21 -25.06 58.45 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.086 -0.507 . . . . 0.22 109.981 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 1.4 mtpp -65.4 -49.34 69.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.799 -0.637 . . . . 0.84999999999999998 110.096 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.37 -27.07 67.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.866 -0.606 . . . . 1.95 110.449 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 840' ' ' MET . . . . . 0.514 ' HG3' ' HG2' ' A' ' 821' ' ' GLU . 10.8 ttp -74.34 -38.23 63.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.945 -0.57 . . . . 0.29999999999999999 110.515 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.616 HD11 HD23 ' A' ' 849' ' ' LEU . 14.3 mt -63.13 -42.24 99.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.085 -0.507 . . . . 0.46999999999999997 110.757 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -68.16 -23.86 64.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.506 . . . . 0.48999999999999999 111.324 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.41 4.21 1.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 1.6799999999999999 110.639 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.445 ' H ' ' C ' ' A' ' 842' ' ' ALA . 35.5 m-80 -151.88 14.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 1.96 110.867 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.9 m120 62.25 14.9 7.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.148 -0.478 . . . . 1.99 111.291 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.04 169.61 9.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.389 . . . . 2.2999999999999998 110.864 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 847' ' ' LYS . . . . . 0.402 ' O ' HG22 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -151.62 -30.67 0.17 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.337 -0.392 . . . . 1.98 111.036 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.409 ' HE1' ' HB2' ' A' ' 784' ' ' LEU . 26.0 m-85 -79.53 149.51 31.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.297 -0.411 . . . . 1.0900000000000001 110.667 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.616 HD23 HD11 ' A' ' 841' ' ' LEU . 0.2 OUTLIER -136.27 114.71 11.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.219 -0.446 . . . . 0.73999999999999999 111.161 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.513 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 24.8 m-20 -72.36 173.41 8.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.292 -0.413 . . . . 1.52 110.718 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.752 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--N 1.332 -0.159 0 CA-C-N 116.414 -0.357 . . . . 1.04 111.492 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.46 0.063 0 CA-C-O 120.676 0.274 . . . . 1.22 110.792 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.563 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -153.86 89.7 1.33 Allowed 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.919 0.39 . . . . 0.93999999999999995 110.399 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.521 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.1 OUTLIER -98.36 93.17 6.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.985 -0.552 . . . . 0.67000000000000004 111.111 -179.564 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.76 161.08 14.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.69 -0.686 . . . . 1.5700000000000001 110.886 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.464 HD12 ' HB2' ' A' ' 847' ' ' LYS . 0.3 OUTLIER -96.56 111.79 23.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.81000000000000005 110.269 179.448 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.496 HG11 ' CH2' ' A' ' 834' ' ' TRP . 30.0 m -97.52 -171.41 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.101 -0.499 . . . . 1.1799999999999999 111.433 -179.428 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.422 ' O ' ' HD2' ' A' ' 838' ' ' LYS . 0.8 OUTLIER -138.78 170.86 15.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.045 -0.525 . . . . 1.3999999999999999 110.838 -179.771 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -85.76 49.98 1.88 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.055 0.455 . . . . 2.8500000000000001 110.512 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.6 p -165.21 -27.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.947 -0.569 . . . . 0.33000000000000002 110.791 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 30.3 m0 -52.6 122.75 9.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.921 -0.582 . . . . 0.29999999999999999 111.85 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 790' ' ' ASN . . . . . 0.643 HD21 ' HB2' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -95.97 159.22 15.08 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.874 -0.787 . . . . 1.8899999999999999 108.874 178.372 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.481 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 86.4 t80 -44.52 -33.01 1.59 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.698 0.285 . . . . 0.63 111.31 -178.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.643 ' HB2' HD21 ' A' ' 790' ' ' ASN . 2.3 m-20 -69.24 -51.91 32.89 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.925 -0.398 . . . . 2.0499999999999998 109.925 178.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 793' ' ' ASP . . . . . 0.613 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.6 OUTLIER -61.11 -29.53 69.82 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 120.995 0.426 . . . . 1.0700000000000001 110.247 179.205 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.559 HD22 ' CE2' ' A' ' 834' ' ' TRP . 34.2 tp -67.17 -52.32 42.82 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.825 -0.625 . . . . 0.93000000000000005 110.384 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.669 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 32.8 mm -57.03 -29.09 30.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.549 -0.751 . . . . 0.32000000000000001 111.706 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.592 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 10.1 mtt -67.94 -53.43 26.35 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.668 0.271 . . . . 1.53 110.336 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.0 -54.35 36.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.144 -0.48 . . . . 0.38 110.117 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 68.5 mt -55.64 -51.1 62.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-N 115.765 -0.652 . . . . 0.5 110.356 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.669 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 3.5 t30 -56.06 -28.45 57.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.624 -0.716 . . . . 0.81000000000000005 111.338 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 43.0 t -77.24 -23.51 51.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.278 -0.419 . . . . 0.97999999999999998 110.875 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.07 0.24 27.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 2.25 111.414 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.582 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.7 pt -120.35 -22.21 3.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.571 -0.286 . . . . 0.75 111.393 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.389 -0.369 . . . . 1.53 110.999 -179.926 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo . . . . . 0 C--O 1.232 0.199 0 CA-C-O 120.824 0.26 . . . . 0.94999999999999996 112.257 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.429 HG13 ' CD1' ' A' ' 802' ' ' ILE . 2.3 mt -125.64 149.26 30.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.064 -0.516 . . . . 1.9399999999999999 111.337 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 2.9 p -122.89 -44.42 2.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.996 -0.547 . . . . 1.1599999999999999 110.836 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.08 130.47 41.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 2.6899999999999999 110.712 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -152.08 168.54 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.972 0.415 . . . . 0.83999999999999997 111.409 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.471 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 16.7 mmtt -113.66 136.9 52.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.784 -0.644 . . . . 0.84999999999999998 110.385 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.592 ' CE1' HG23 ' A' ' 826' ' ' VAL . 4.2 p90 -114.85 173.32 6.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.811 0.338 . . . . 0.70999999999999996 111.274 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -100.38 108.29 20.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.081 -0.509 . . . . 1.9099999999999999 110.504 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.461 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 4.1 t70 -79.08 173.6 12.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.824 -0.626 . . . . 1.8 110.829 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.11 10.09 2.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.245 -0.434 . . . . 1.6200000000000001 111.043 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.86 10.38 41.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 1.6499999999999999 110.848 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 61.71 51.73 55.46 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.859 -0.686 . . . . 0.88 112.468 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.96 141.87 0.27 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.024 0.44 . . . . 1.8600000000000001 110.429 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.49 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 63.6 m-85 -66.15 142.85 57.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.836 -0.62 . . . . 0.64000000000000001 110.488 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.592 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -133.1 173.03 15.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.219 -0.446 . . . . 0.96999999999999997 110.486 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.57 113.71 34.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.931 0.396 . . . . 0.56000000000000005 111.42 -179.288 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.9 tt -80.25 115.7 19.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.776 -0.647 . . . . 0.81000000000000005 110.952 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -61.52 -69.25 1.35 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.852 -0.69 . . . . 0.81000000000000005 112.549 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 830' ' ' SER . . . . . 0.48 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 1.2 p -170.51 -140.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 110.442 -0.207 . . . . 1.3100000000000001 110.442 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.48 ' H ' ' HB2' ' A' ' 830' ' ' SER . 0.9 OUTLIER -55.61 -24.05 30.98 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.745 0.307 . . . . 2.2000000000000002 111.033 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -64.94 0.8 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.392 -0.367 . . . . 2.21 110.757 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.83 -13.92 28.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.72999999999999998 110.641 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.559 ' CE2' HD22 ' A' ' 794' ' ' LEU . 5.3 t-105 -86.58 -44.25 12.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.381 -0.372 . . . . 0.26000000000000001 110.192 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -64.84 -27.7 69.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.189 0.518 . . . . 1.98 109.835 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 88.4 t -82.54 -58.32 3.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.474 -0.785 . . . . 0.67000000000000004 110.108 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -52.94 -30.96 37.64 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.135 -0.484 . . . . 0.22 110.533 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' A' ' 786' ' ' GLU . 11.9 ttpt -69.66 -52.18 28.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.801 -0.636 . . . . 0.84999999999999998 109.979 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.32 -26.55 61.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.438 -0.801 . . . . 1.95 110.162 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 12.3 ttp -70.83 -40.87 72.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.772 -0.649 . . . . 0.29999999999999999 110.232 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.84 HD11 HD23 ' A' ' 849' ' ' LEU . 17.4 mt -62.27 -35.22 78.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.736 -0.665 . . . . 0.46999999999999997 110.814 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -73.82 -22.26 59.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.321 -0.399 . . . . 0.48999999999999999 111.178 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -69.77 6.27 1.22 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 1.6799999999999999 110.667 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.441 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.03 22.36 0.5 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.028 -0.533 . . . . 1.96 110.852 -179.902 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 58.05 16.12 3.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.102 -0.499 . . . . 1.99 111.181 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 846' ' ' GLU . . . . . 0.464 ' HB3' HD22 ' A' ' 841' ' ' LEU . 3.7 mt-10 -82.72 140.39 33.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 2.2999999999999998 110.807 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 847' ' ' LYS . . . . . 0.464 ' HB2' HD12 ' A' ' 784' ' ' LEU . 0.1 OUTLIER -135.74 30.6 3.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 1.98 110.759 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.521 ' HB3' HG22 ' A' ' 782' ' ' THR . 8.9 m-85 -125.88 126.0 43.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.117 -0.492 . . . . 1.0900000000000001 110.889 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.84 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -115.36 117.77 31.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 0.73999999999999999 110.502 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.444 ' C ' HG12 ' A' ' 851' ' ' ILE . 1.9 m-20 -84.21 152.91 23.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.261 -0.427 . . . . 1.52 111.481 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.563 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.333 -0.112 0 CA-C-N 116.088 -0.505 . . . . 1.04 111.19 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.487 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.582 0.229 . . . . 1.22 110.702 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.797 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.2 OUTLIER -158.23 93.03 1.2 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.982 0.42 . . . . 0.93999999999999995 110.138 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.97 92.21 5.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.024 -0.535 . . . . 0.67000000000000004 110.989 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.08 139.89 30.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.741 -0.663 . . . . 1.5700000000000001 110.962 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.614 HD12 ' HE1' ' A' ' 848' ' ' PHE . 6.4 tt -72.32 104.21 3.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.935 0.398 . . . . 0.81000000000000005 110.59 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.611 HG11 ' CZ2' ' A' ' 834' ' ' TRP . 67.8 t -94.68 147.3 5.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.018 -0.537 . . . . 1.1799999999999999 111.372 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -96.06 170.82 9.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 1.3999999999999999 110.548 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.44 54.18 3.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.359 -0.382 . . . . 2.8500000000000001 110.762 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.5 p -166.75 -24.07 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.108 -0.496 . . . . 0.33000000000000002 111.036 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 789' ' ' TRP . . . . . 0.474 ' CE3' HG13 ' A' ' 785' ' ' VAL . 38.2 m0 -53.51 122.28 9.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.081 -0.509 . . . . 0.29999999999999999 112.034 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 790' ' ' ASN . . . . . 0.767 HD21 ' HB2' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -95.33 158.12 15.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.613 -0.884 . . . . 1.8899999999999999 108.613 178.294 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.496 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 92.7 t80 -42.54 -33.81 0.75 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.748 0.308 . . . . 0.63 111.336 -178.7 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.767 ' HB2' HD21 ' A' ' 790' ' ' ASN . 1.5 m-20 -69.02 -55.01 12.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.791 -0.448 . . . . 2.0499999999999998 109.791 178.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 793' ' ' ASP . . . . . 0.608 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.7 OUTLIER -59.56 -29.71 68.12 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 120.974 0.416 . . . . 1.0700000000000001 110.498 179.302 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.578 HD22 ' CE2' ' A' ' 834' ' ' TRP . 32.4 tp -66.27 -52.95 42.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.897 -0.592 . . . . 0.93000000000000005 110.217 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.692 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.3 mm -57.26 -31.84 39.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.47 -0.786 . . . . 0.32000000000000001 111.527 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.645 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.2 mtt -68.17 -53.85 22.12 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.983 -0.287 . . . . 1.53 110.539 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -52.27 -53.68 40.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.027 0.442 . . . . 0.38 110.085 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.491 ' O ' HG12 ' A' ' 802' ' ' ILE . 94.2 mt -56.81 -53.2 45.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.668 -0.696 . . . . 0.5 110.509 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.692 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -53.52 -28.0 28.8 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.648 -0.705 . . . . 0.81000000000000005 111.285 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.07 -30.91 61.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.466 -0.334 . . . . 0.97999999999999998 111.065 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.39 0.74 45.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.326 -0.397 . . . . 2.25 111.512 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 4.1 pt -122.4 -14.65 6.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.67 0.272 . . . . 0.75 111.611 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 2.2 t . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.773 0.321 . . . . 1.53 111.198 -179.893 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo . . . . . 0 C--O 1.23 0.115 0 CA-C-O 120.773 0.239 . . . . 0.94999999999999996 112.08 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 14.5 mm -110.56 152.35 12.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.455 . . . . 1.9399999999999999 111.002 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.58 -56.18 1.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 1.1599999999999999 111.162 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 815' ' ' LYS . . . . . 0.402 ' HE2' HG12 ' A' ' 827' ' ' VAL . 1.3 tttt -92.59 118.47 31.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.247 -0.433 . . . . 2.6899999999999999 110.872 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 816' ' ' ILE . . . . . 0.574 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -134.61 169.22 21.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.093 -0.503 . . . . 0.83999999999999997 111.299 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.401 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 12.4 mmtt -107.64 172.26 6.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.969 -0.56 . . . . 0.84999999999999998 110.553 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.599 ' CE1' HG23 ' A' ' 826' ' ' VAL . 11.0 p90 -156.19 153.03 28.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.02 0.438 . . . . 0.70999999999999996 111.524 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -80.04 106.65 12.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.763 -0.653 . . . . 1.9099999999999999 110.694 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.412 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 6.9 t0 -78.75 178.51 7.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.552 -0.749 . . . . 1.8 110.819 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -80.11 41.58 0.53 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.227 -0.442 . . . . 1.6200000000000001 111.236 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -139.76 10.87 2.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 1.6499999999999999 110.759 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 62.9 50.15 66.28 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.852 -0.69 . . . . 0.88 112.452 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -173.96 134.95 0.47 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.985 0.421 . . . . 1.8600000000000001 110.659 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 825' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -64.17 148.41 50.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.883 -0.599 . . . . 0.64000000000000001 110.778 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.599 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -136.93 176.56 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.96999999999999997 110.642 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 827' ' ' VAL . . . . . 0.402 HG12 ' HE2' ' A' ' 815' ' ' LYS . 0.2 OUTLIER -99.24 110.91 27.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.914 0.387 . . . . 0.56000000000000005 111.138 -179.774 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 5.9 tt -79.69 124.07 28.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.81000000000000005 110.869 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -69.87 -66.16 2.32 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.812 -0.709 . . . . 0.81000000000000005 112.453 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.02 -140.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.467 0.175 . . . . 1.3100000000000001 110.617 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.429 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 1.9 p30 -58.12 -18.72 27.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.779 0.323 . . . . 2.2000000000000002 111.048 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.419 ' O ' HG23 ' A' ' 836' ' ' VAL . 2.6 mt-10 -72.23 -68.14 0.49 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.261 -0.427 . . . . 2.21 110.715 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.88 -12.27 23.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.312 -0.404 . . . . 0.72999999999999998 110.668 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.611 ' CZ2' HG11 ' A' ' 785' ' ' VAL . 2.1 t-105 -85.23 -41.8 15.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.26000000000000001 110.249 179.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.553 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -68.33 -36.7 79.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.892 -0.594 . . . . 1.98 109.489 178.984 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 832' ' ' GLU . 64.5 t -70.62 -55.27 14.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.354 -0.839 . . . . 0.67000000000000004 109.913 179.016 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.21 -24.34 53.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.953 -0.567 . . . . 0.22 110.533 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.553 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 28.7 mtmt -71.42 -49.63 39.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 0.84999999999999998 110.366 179.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 839' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 0.5 OUTLIER -61.26 -21.91 64.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.977 -0.556 . . . . 1.95 110.214 179.424 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.6 ttp -77.79 -36.39 50.48 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.704 -0.68 . . . . 0.29999999999999999 110.454 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.877 HD11 HD23 ' A' ' 849' ' ' LEU . 17.2 mt -66.1 -48.8 69.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 0.46999999999999997 110.629 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.446 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.81 -30.5 71.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.165 -0.47 . . . . 0.48999999999999999 111.097 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 843' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 0.7 OUTLIER -69.27 5.86 1.16 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.154 -0.476 . . . . 1.6799999999999999 110.593 179.741 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.446 ' H ' ' C ' ' A' ' 842' ' ' ALA . 9.0 m-80 -143.2 19.36 1.92 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 1.96 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 62.06 9.96 3.4 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.115 -0.493 . . . . 1.99 111.346 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.33 174.36 10.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.499 -0.319 . . . . 2.2999999999999998 110.909 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -157.65 -32.63 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 1.98 110.84 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.614 ' HE1' HD12 ' A' ' 784' ' ' LEU . 2.3 m-85 -80.27 147.95 30.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 1.0900000000000001 110.86 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.877 HD23 HD11 ' A' ' 841' ' ' LEU . 0.6 OUTLIER -125.01 128.38 48.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 0.73999999999999999 111.011 -179.857 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.524 ' O ' HD13 ' A' ' 849' ' ' LEU . 6.0 m120 -79.15 160.08 27.15 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.173 -0.467 . . . . 1.52 110.978 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.797 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.1 mm . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.439 -0.346 . . . . 1.04 111.63 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.515 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.621 0.248 . . . . 1.22 110.836 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.812 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.24 98.39 1.29 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.043 0.449 . . . . 0.93999999999999995 109.873 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.466 HG23 ' OD1' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -96.73 86.97 4.2 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.824 -0.626 . . . . 0.67000000000000004 110.678 -179.442 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.491 ' O ' HG23 ' A' ' 785' ' ' VAL . 0.2 OUTLIER -82.11 117.43 22.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.244 -0.889 . . . . 1.5700000000000001 110.991 -179.723 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.442 HD12 ' CE1' ' A' ' 848' ' ' PHE . 0.7 OUTLIER -63.12 110.93 2.0 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.085 0.469 . . . . 0.81000000000000005 110.299 179.672 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.72 HG11 ' HZ2' ' A' ' 834' ' ' TRP . 46.8 t -107.03 152.78 8.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.708 -0.678 . . . . 1.1799999999999999 111.703 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.402 ' N ' HG12 ' A' ' 785' ' ' VAL . 1.0 OUTLIER -101.05 172.04 7.26 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.803 -0.635 . . . . 1.3999999999999999 110.416 179.4 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.27 53.24 2.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.962 0.411 . . . . 2.8500000000000001 110.622 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.2 p -164.19 -27.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.991 -0.55 . . . . 0.33000000000000002 111.097 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 789' ' ' TRP . . . . . 0.559 ' CE3' HG13 ' A' ' 785' ' ' VAL . 38.3 m0 -53.23 126.01 19.54 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.092 -0.504 . . . . 0.29999999999999999 112.14 -179.371 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.13 170.11 9.76 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.626 -0.879 . . . . 1.8899999999999999 108.626 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.425 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 49.8 t80 -56.15 -25.27 45.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.97 0.414 . . . . 0.63 110.161 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 796' ' ' MET . 26.2 t70 -72.6 -59.82 2.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.912 -0.585 . . . . 2.0499999999999998 109.933 178.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.29 -32.68 64.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.284 -0.416 . . . . 1.0700000000000001 110.125 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.599 HD22 ' CE2' ' A' ' 834' ' ' TRP . 22.3 tp -64.31 -53.38 49.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.951 -0.568 . . . . 0.93000000000000005 110.789 179.632 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.694 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 17.4 mm -56.34 -30.81 31.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.768 -0.651 . . . . 0.32000000000000001 111.689 -179.443 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 2.6 mtt -68.85 -56.31 8.36 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.234 -0.186 . . . . 1.53 110.964 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -52.03 -51.36 57.95 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.232 0.539 . . . . 0.38 110.131 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.511 ' O ' HG12 ' A' ' 802' ' ' ILE . 79.5 mt -58.76 -52.78 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-N 115.505 -0.77 . . . . 0.5 110.797 179.164 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.694 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t-20 -50.49 -31.73 16.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.801 -0.636 . . . . 0.81000000000000005 111.536 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.54 -34.19 67.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.441 -0.345 . . . . 0.97999999999999998 110.802 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.54 8.49 44.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 2.25 111.99 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.568 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 3.3 pt -129.14 -19.1 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 111.824 0.305 . . . . 0.75 111.824 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.577 -0.283 . . . . 1.53 111.044 -179.948 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 812' ' ' PRO . . . . . 0.413 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 35.1 Cg_exo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.856 0.274 . . . . 0.94999999999999996 112.32 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 1.9 mt -109.48 159.58 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 1.9399999999999999 110.8 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 9.5 p -126.42 -51.17 1.51 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.433 -0.348 . . . . 1.1599999999999999 111.611 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.67 125.68 29.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.9 0.381 . . . . 2.6899999999999999 111.033 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.5 pp -146.59 160.63 10.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.83999999999999997 111.339 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.47 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 16.5 mmtt -102.51 164.12 11.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.995 -0.548 . . . . 0.84999999999999998 110.52 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.556 ' CE1' HG23 ' A' ' 826' ' ' VAL . 12.2 p90 -145.77 153.4 40.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.948 0.404 . . . . 0.70999999999999996 111.312 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 819' ' ' GLN . . . . . 0.471 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.6 OUTLIER -76.72 104.76 7.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.924 -0.58 . . . . 1.9099999999999999 110.751 -179.611 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.537 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.8 t70 -79.26 173.98 12.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.581 -0.736 . . . . 1.8 111.055 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 821' ' ' GLU . . . . . 0.454 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 6.7 pt-20 -74.1 9.42 1.6 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.14 -0.482 . . . . 1.6200000000000001 111.446 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.72 14.47 29.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.386 -0.37 . . . . 1.6499999999999999 110.802 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 59.07 46.93 93.01 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.751 -0.738 . . . . 0.88 112.376 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -174.5 136.43 0.45 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.025 0.44 . . . . 1.8600000000000001 110.546 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.474 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 91.6 m-85 -63.21 140.7 58.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.751 -0.659 . . . . 0.64000000000000001 110.915 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.556 HG23 ' CE1' ' A' ' 818' ' ' TYR . 2.4 m -130.36 -179.6 3.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.082 -0.508 . . . . 0.96999999999999997 110.648 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.85 112.7 31.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.05 0.452 . . . . 0.56000000000000005 111.388 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.405 ' HB2' ' CD1' ' A' ' 818' ' ' TYR . 0.7 OUTLIER -81.52 123.89 29.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.81000000000000005 110.856 179.892 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -63.5 -65.74 2.91 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.806 -0.711 . . . . 0.81000000000000005 112.443 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 830' ' ' SER . . . . . 0.423 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 2.1 p -173.97 -131.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.241 -0.281 . . . . 1.3100000000000001 110.241 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.423 ' H ' ' HB2' ' A' ' 830' ' ' SER . 4.8 p-10 -64.03 -14.24 52.82 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.811 0.338 . . . . 2.2000000000000002 110.743 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.571 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.0 OUTLIER -74.34 -69.84 0.43 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.141 -0.482 . . . . 2.21 110.697 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 833' ' ' ASP . . . . . 0.404 ' HB2' ' HG ' ' A' ' 828' ' ' LEU . 3.7 m-20 -59.69 -14.53 14.43 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.149 -0.478 . . . . 0.72999999999999998 110.395 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.72 ' HZ2' HG11 ' A' ' 785' ' ' VAL . 1.3 t-105 -81.18 -43.54 19.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.127 -0.488 . . . . 0.26000000000000001 110.094 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.756 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -67.3 -35.93 80.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.025 -0.534 . . . . 1.98 109.78 178.927 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 832' ' ' GLU . 21.8 t -71.22 -55.74 12.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.398 -0.819 . . . . 0.67000000000000004 110.274 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.75 -24.15 55.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.005 -0.543 . . . . 0.22 110.591 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.756 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 31.5 mtmt -71.95 -42.26 66.8 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.163 -0.471 . . . . 0.84999999999999998 110.293 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -65.45 -27.63 68.65 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.103 -0.498 . . . . 1.95 110.014 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 840' ' ' MET . . . . . 0.454 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 12.4 ttp -72.27 -35.13 68.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.743 -0.662 . . . . 0.29999999999999999 110.343 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.713 HD11 HD23 ' A' ' 849' ' ' LEU . 50.4 mt -70.47 -51.97 25.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.816 -0.629 . . . . 0.46999999999999997 110.811 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.42 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -75.69 -0.63 21.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.48999999999999999 111.359 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -65.85 -0.75 2.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.992 0.425 . . . . 1.6799999999999999 110.299 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 842' ' ' ALA . 69.8 m-80 -150.67 -71.39 0.17 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.852 -0.613 . . . . 1.96 110.507 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.38 27.18 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.885 -0.598 . . . . 1.99 111.0 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 846' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' A' ' 841' ' ' LEU . 4.5 mt-10 -87.61 156.29 19.56 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.87 0.367 . . . . 2.2999999999999998 111.038 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -145.85 -29.07 0.42 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.039 -0.528 . . . . 1.98 110.956 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.442 ' CE1' HD12 ' A' ' 784' ' ' LEU . 36.6 m-85 -79.8 157.29 27.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.183 -0.462 . . . . 1.0900000000000001 110.922 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.713 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -141.24 126.48 18.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.73999999999999999 110.852 179.815 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.471 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 76.0 m-20 -77.47 161.2 28.13 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.362 -0.381 . . . . 1.52 111.171 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.812 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-N 116.346 -0.388 . . . . 1.04 111.527 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.421 HG22 ' H ' ' A' ' 851' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.707 0.289 . . . . 1.22 110.973 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.706 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.68 91.11 1.28 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.05 0.452 . . . . 0.93999999999999995 110.113 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.478 HG23 ' CG ' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -98.33 92.89 5.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 0.67000000000000004 111.106 -179.414 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.64 157.77 17.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.688 -0.687 . . . . 1.5700000000000001 110.746 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.75 112.78 23.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.417 -0.356 . . . . 0.81000000000000005 110.381 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.643 HG11 ' CZ2' ' A' ' 834' ' ' TRP . 23.5 t -107.6 153.63 8.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.035 -0.53 . . . . 1.1799999999999999 111.515 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.406 ' N ' HG12 ' A' ' 785' ' ' VAL . 0.2 OUTLIER -104.82 175.37 5.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.883 -0.598 . . . . 1.3999999999999999 110.453 179.509 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -90.0 55.63 3.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.991 0.424 . . . . 2.8500000000000001 110.734 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.5 p -168.07 -26.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.052 -0.522 . . . . 0.33000000000000002 111.156 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 789' ' ' TRP . . . . . 0.575 ' CE3' HG13 ' A' ' 785' ' ' VAL . 36.1 m0 -52.42 125.42 16.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.29999999999999999 111.767 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.68 169.78 10.23 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.808 -0.812 . . . . 1.8899999999999999 108.808 178.353 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.448 ' O ' HG12 ' A' ' 795' ' ' ILE . 10.1 t80 -55.62 -25.02 36.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.984 0.421 . . . . 0.63 109.912 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.593 ' O ' ' HG3' ' A' ' 796' ' ' MET . 4.6 m-20 -73.22 -61.18 1.91 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.896 -0.593 . . . . 2.0499999999999998 109.679 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.94 -32.05 60.97 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 116.229 -0.441 . . . . 1.0700000000000001 110.321 179.206 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.569 HD22 ' CE2' ' A' ' 834' ' ' TRP . 23.2 tp -64.42 -52.78 56.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.814 -0.63 . . . . 0.93000000000000005 110.506 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.663 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 21.2 mm -59.55 -30.83 45.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.697 -0.683 . . . . 0.32000000000000001 111.571 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.593 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 3.2 mtt -68.56 -53.76 20.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.61 0.243 . . . . 1.53 110.736 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.09 -49.57 66.17 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.082 0.467 . . . . 0.38 110.285 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.409 HG22 HG12 ' A' ' 802' ' ' ILE . 56.5 mt -60.83 -52.84 56.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.623 -0.717 . . . . 0.5 110.546 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.663 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 2.6 t30 -51.81 -23.71 5.07 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.604 -0.725 . . . . 0.81000000000000005 111.548 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.46 -33.8 31.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.384 -0.371 . . . . 0.97999999999999998 110.676 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -94.81 4.17 54.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.061 -0.518 . . . . 2.25 111.454 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.576 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.1 pt -124.6 -35.04 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 111.725 0.269 . . . . 0.75 111.725 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 803' ' ' SER . . . . . 0.467 ' N ' HG13 ' A' ' 802' ' ' ILE . 23.0 p . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.946 0.403 . . . . 1.53 111.071 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 C--O 1.23 0.124 0 CA-C-O 120.794 0.247 . . . . 0.94999999999999996 112.02 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 2.8 pt -147.79 139.07 17.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.309 -0.405 . . . . 1.9399999999999999 111.326 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 72.0 p -114.18 -46.32 3.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 1.1599999999999999 111.078 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -99.1 127.28 45.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 2.6899999999999999 110.861 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.1 pp -153.82 171.51 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.173 -0.467 . . . . 0.83999999999999997 111.229 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -101.49 175.07 5.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.84999999999999998 110.821 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.662 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 27.5 p90 -145.6 156.75 43.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.225 -0.443 . . . . 0.70999999999999996 111.08 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 819' ' ' GLN . . . . . 0.523 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.8 OUTLIER -86.93 106.49 17.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.228 0.537 . . . . 1.9099999999999999 110.59 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -79.4 177.76 8.61 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.426 -0.806 . . . . 1.8 110.886 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 821' ' ' GLU . . . . . 0.507 ' HG2' ' HG3' ' A' ' 840' ' ' MET . 0.2 OUTLIER -80.69 13.2 2.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.121 -0.49 . . . . 1.6200000000000001 111.088 -179.852 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -99.75 -11.82 20.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 1.6499999999999999 110.743 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 94.39 11.36 57.28 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.705 -0.759 . . . . 0.88 112.618 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -128.5 -153.49 0.57 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.997 0.427 . . . . 1.8600000000000001 110.612 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.475 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 63.0 m-85 -133.26 134.94 44.58 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.918 -0.583 . . . . 0.64000000000000001 111.195 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.662 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 1.5 t -111.32 173.18 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 116.052 -0.522 . . . . 0.96999999999999997 110.946 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 827' ' ' VAL . . . . . 0.586 ' H ' HG12 ' A' ' 826' ' ' VAL . 6.1 t -99.45 107.06 19.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.797 0.332 . . . . 0.56000000000000005 111.074 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 7.5 tp -79.76 104.92 10.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.81000000000000005 110.672 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.11 -63.66 3.68 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.831 -0.7 . . . . 0.81000000000000005 112.712 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 830' ' ' SER . . . . . 0.521 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -166.64 -142.45 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.465 0.174 . . . . 1.3100000000000001 110.571 -179.795 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.521 ' H ' ' HB3' ' A' ' 830' ' ' SER . 4.6 t0 -59.66 -14.1 12.45 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.739 0.304 . . . . 2.2000000000000002 110.925 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.405 ' O ' HG23 ' A' ' 836' ' ' VAL . 2.9 mt-10 -73.8 -70.88 0.35 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.289 -0.414 . . . . 2.21 110.733 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -63.31 -11.91 25.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.72999999999999998 110.357 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.643 ' CZ2' HG11 ' A' ' 785' ' ' VAL . 1.5 t-105 -83.1 -39.69 20.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.18 -0.464 . . . . 0.26000000000000001 109.898 179.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.719 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -69.9 -36.36 75.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.893 -0.594 . . . . 1.98 109.936 178.865 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 832' ' ' GLU . 44.2 t -72.01 -54.54 16.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.419 -0.81 . . . . 0.67000000000000004 110.296 179.359 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.39 -24.85 61.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.099 -0.501 . . . . 0.22 110.462 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.719 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.0 mtmt -69.77 -43.46 72.16 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.101 -0.5 . . . . 0.84999999999999998 110.367 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -64.41 -26.21 68.36 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 1.95 110.031 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 840' ' ' MET . . . . . 0.507 ' HG3' ' HG2' ' A' ' 821' ' ' GLU . 7.6 ttp -72.92 -36.5 67.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.667 -0.697 . . . . 0.29999999999999999 110.155 179.392 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.592 HD11 HD23 ' A' ' 849' ' ' LEU . 3.2 mt -68.59 -44.28 74.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.585 . . . . 0.46999999999999997 110.773 179.798 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.423 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.46 -23.51 66.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.48999999999999999 111.179 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.8 3.81 1.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 1.6799999999999999 110.591 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 842' ' ' ALA . 38.6 m-80 -151.31 16.69 0.73 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.968 -0.56 . . . . 1.96 110.692 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 24.0 t30 58.59 19.68 6.91 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.01 -0.541 . . . . 1.99 111.102 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.16 161.06 29.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 2.2999999999999998 111.024 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -152.54 10.25 0.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 1.98 110.696 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.416 ' HB3' HG22 ' A' ' 782' ' ' THR . 74.6 m-85 -112.97 125.91 54.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.957 -0.565 . . . . 1.0900000000000001 110.765 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.592 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -122.06 119.08 30.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.73999999999999999 111.002 -179.688 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.523 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 23.2 m-20 -82.17 174.68 10.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 1.52 111.178 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.706 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.6 mm . . . . . 0 C--N 1.333 -0.145 0 CA-C-N 116.165 -0.471 . . . . 1.04 111.167 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.757 0.313 . . . . 1.22 110.978 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.774 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -144.21 84.15 1.75 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.254 -0.43 . . . . 0.93999999999999995 109.971 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.524 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.3 OUTLIER -98.5 102.64 14.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.67000000000000004 111.602 -179.258 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.54 -164.87 1.19 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.009 -0.541 . . . . 1.5700000000000001 110.342 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.412 HD12 ' CE1' ' A' ' 848' ' ' PHE . 0.6 OUTLIER -119.04 108.83 15.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.012 0.434 . . . . 0.81000000000000005 110.151 179.325 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.476 HG13 ' CE3' ' A' ' 789' ' ' TRP . 90.3 t -101.88 147.11 9.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.664 -0.698 . . . . 1.1799999999999999 111.155 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -103.98 168.84 8.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.257 -0.429 . . . . 1.3999999999999999 110.953 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.82 56.53 3.93 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.193 0.52 . . . . 2.8500000000000001 110.488 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 1.7 p -164.32 -27.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.515 -0.766 . . . . 0.33000000000000002 110.49 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 789' ' ' TRP . . . . . 0.476 ' CE3' HG13 ' A' ' 785' ' ' VAL . 30.3 m0 -50.52 124.25 10.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.498 -0.774 . . . . 0.29999999999999999 111.897 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 790' ' ' ASN . . . . . 0.753 ' ND2' ' H ' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -93.43 162.62 13.91 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.916 -0.772 . . . . 1.8899999999999999 108.916 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -44.04 -30.18 0.7 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.824 0.345 . . . . 0.63 111.395 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.753 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 13.1 t0 -76.69 -59.01 2.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.233 -0.44 . . . . 2.0499999999999998 110.143 179.156 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -53.12 -21.69 5.21 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.553 0.692 . . . . 1.0700000000000001 109.271 178.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.443 HD13 ' N ' ' A' ' 795' ' ' ILE . 1.3 tm? -74.19 -75.58 0.15 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.766 -1.106 . . . . 0.93000000000000005 109.988 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.631 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 23.4 mm -46.44 -32.38 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.032 -0.985 . . . . 0.32000000000000001 111.98 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.624 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 26.1 mtm -69.93 -42.23 73.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.711 0.291 . . . . 1.53 110.836 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -63.73 -47.68 80.09 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.012 0.434 . . . . 0.38 110.101 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 802' ' ' ILE . 31.2 mt -62.74 -50.23 80.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.711 -0.677 . . . . 0.5 110.176 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.631 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 4.2 t30 -52.19 -32.63 37.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.6 -0.727 . . . . 0.81000000000000005 111.242 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.87 -32.69 65.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.97999999999999998 110.79 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 801' ' ' LYS . . . . . 0.457 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 4.4 mmtt -88.05 -5.06 58.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.093 -0.503 . . . . 2.25 111.374 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.631 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.3 pp -111.79 -21.65 5.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.498 -0.319 . . . . 0.75 111.423 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.342 -0.39 . . . . 1.53 111.085 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 812' ' ' PRO . . . . . 0.533 ' CB ' HD22 ' A' ' 799' ' ' ASN . 56.7 Cg_endo . . . . . 0 C--O 1.231 0.156 0 CA-C-O 120.87 0.279 . . . . 0.94999999999999996 112.392 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.559 HG12 HD13 ' A' ' 802' ' ' ILE . 11.6 pt -135.59 -178.22 2.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 1.9399999999999999 111.084 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 8.9 p -142.73 -66.32 0.39 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.093 -0.503 . . . . 1.1599999999999999 111.097 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.03 129.68 34.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.148 -0.478 . . . . 2.6899999999999999 110.66 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.3 pp -146.05 161.53 11.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.065 0.459 . . . . 0.83999999999999997 111.495 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -102.31 160.03 14.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.746 -0.661 . . . . 0.84999999999999998 110.496 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.605 ' CE1' HG23 ' A' ' 826' ' ' VAL . 11.0 p90 -145.31 156.49 43.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.973 0.416 . . . . 0.70999999999999996 111.307 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -78.59 107.01 10.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.832 -0.622 . . . . 1.9099999999999999 110.738 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.418 ' HB2' HG22 ' A' ' 826' ' ' VAL . 2.7 t0 -78.27 176.41 9.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.631 -0.713 . . . . 1.8 110.578 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -76.04 4.76 7.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.438 . . . . 1.6200000000000001 111.409 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -102.65 16.01 27.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.408 -0.36 . . . . 1.6499999999999999 110.833 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 57.73 50.56 64.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.822 -0.704 . . . . 0.88 112.358 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -173.1 132.89 0.51 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.794 0.331 . . . . 1.8600000000000001 110.635 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.475 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 71.6 m-85 -61.03 142.55 56.54 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.097 -0.501 . . . . 0.64000000000000001 110.682 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.605 HG23 ' CE1' ' A' ' 818' ' ' TYR . 2.4 m -134.66 179.39 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.297 -0.41 . . . . 0.96999999999999997 111.037 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -99.14 113.11 33.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.969 0.414 . . . . 0.56000000000000005 111.371 -179.434 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.24 120.81 24.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.825 -0.625 . . . . 0.81000000000000005 110.835 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.12 -68.27 1.71 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.844 -0.693 . . . . 0.81000000000000005 112.606 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -170.8 -144.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.485 -0.191 . . . . 1.3100000000000001 110.485 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -53.77 -25.03 17.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.74 0.305 . . . . 2.2000000000000002 111.081 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.502 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.1 OUTLIER -66.65 -66.59 0.53 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.233 -0.439 . . . . 2.21 110.656 179.751 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.22 -12.14 37.89 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.277 -0.42 . . . . 0.72999999999999998 110.348 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.467 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 3.6 t-105 -81.88 -40.02 23.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.26000000000000001 109.808 178.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.698 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 11.6 m-80 -71.02 -32.04 68.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 1.98 109.883 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 832' ' ' GLU . 39.7 t -75.34 -53.77 15.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.715 -0.675 . . . . 0.67000000000000004 109.818 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -56.33 -28.11 57.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.996 -0.547 . . . . 0.22 110.315 179.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.698 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.1 mtmt -71.86 -48.41 46.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.854 -0.612 . . . . 0.84999999999999998 110.267 179.412 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.12 -22.49 66.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.944 -0.571 . . . . 1.95 110.104 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 1.2 ttp -77.54 -35.16 53.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.811 -0.631 . . . . 0.29999999999999999 110.266 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.772 HD11 HD23 ' A' ' 849' ' ' LEU . 10.2 mt -66.33 -48.86 68.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.917 -0.583 . . . . 0.46999999999999997 110.805 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.443 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.51 -29.69 70.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.414 . . . . 0.48999999999999999 111.017 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -70.63 8.59 0.82 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.984 -0.553 . . . . 1.6799999999999999 110.792 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.443 ' H ' ' C ' ' A' ' 842' ' ' ALA . 40.4 m-80 -148.55 19.63 1.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 1.96 111.005 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 62.77 10.84 4.49 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.206 -0.452 . . . . 1.99 111.064 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 846' ' ' GLU . . . . . 0.47 ' HB3' HD23 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -86.38 147.1 26.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 2.2999999999999998 110.859 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.45 -18.91 1.45 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 1.98 110.931 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.524 ' HB3' HG22 ' A' ' 782' ' ' THR . 25.2 m-85 -87.96 147.02 25.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.278 -0.419 . . . . 1.0900000000000001 110.764 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.772 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -124.03 133.49 53.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.905 0.384 . . . . 0.73999999999999999 111.321 -179.498 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.457 ' O ' HD13 ' A' ' 849' ' ' LEU . 29.3 m-80 -92.48 157.75 16.4 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.989 -0.55 . . . . 1.52 110.747 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.774 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.331 -0.199 0 CA-C-N 116.465 -0.334 . . . . 1.04 111.82 -179.479 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.422 HG23 ' HZ ' ' A' ' 825' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.839 0.352 . . . . 1.22 110.877 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 1.009 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -150.83 89.72 1.56 Allowed 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.594 -0.521 . . . . 0.93999999999999995 109.594 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.1 OUTLIER -97.99 110.6 23.15 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.816 -0.629 . . . . 0.67000000000000004 111.473 -179.013 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.524 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -110.6 -167.67 1.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.801 -0.636 . . . . 1.5700000000000001 110.606 179.765 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.57 109.24 18.67 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.027 -0.533 . . . . 0.81000000000000005 110.194 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.424 HG21 ' HH2' ' A' ' 834' ' ' TRP . 27.9 m -105.79 172.73 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 1.1799999999999999 111.462 -179.089 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -129.4 158.43 39.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.943 -0.571 . . . . 1.3999999999999999 110.875 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -9.56 51.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 2.8500000000000001 110.959 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.8 p -95.05 -24.97 4.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.884 -0.598 . . . . 0.33000000000000002 110.762 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 27.0 m0 -58.41 124.72 20.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.738 -0.665 . . . . 0.29999999999999999 111.854 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 790' ' ' ASN . . . . . 0.85 HD21 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -98.06 161.35 13.76 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.916 -0.772 . . . . 1.8899999999999999 108.916 178.394 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.46 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 53.5 t80 -44.36 -33.13 1.54 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.829 0.347 . . . . 0.63 111.138 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.85 ' HB3' HD21 ' A' ' 790' ' ' ASN . 35.7 t70 -69.52 -55.21 10.84 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.669 -0.493 . . . . 2.0499999999999998 109.669 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 793' ' ' ASP . . . . . 0.631 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.6 OUTLIER -58.74 -23.65 60.26 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.167 0.508 . . . . 1.0700000000000001 110.31 179.124 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.551 HD22 ' CE2' ' A' ' 834' ' ' TRP . 34.5 tp -74.05 -54.35 8.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.62 -0.718 . . . . 0.93000000000000005 110.367 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.68 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 32.0 mm -57.41 -31.45 38.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.593 -0.73 . . . . 0.32000000000000001 111.74 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.681 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 33.4 mtm -68.14 -50.23 56.0 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.965 -0.294 . . . . 1.53 110.417 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.72 -52.64 61.83 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.026 0.441 . . . . 0.38 109.99 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.68 -51.4 72.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.731 -0.668 . . . . 0.5 110.61 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.68 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.7 OUTLIER -57.15 -24.39 53.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.61 -0.723 . . . . 0.81000000000000005 111.199 -179.754 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 34.6 m -79.8 -26.72 40.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.108 -0.496 . . . . 0.97999999999999998 110.644 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 801' ' ' LYS . . . . . 0.504 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -98.91 -3.97 33.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.092 -0.503 . . . . 2.25 111.19 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.594 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.2 pt -116.69 -25.52 3.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.76 0.314 . . . . 0.75 111.437 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 803' ' ' SER . . . . . 0.448 ' N ' HG13 ' A' ' 802' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 1.53 111.134 -179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 812' ' ' PRO . . . . . 0.426 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 46.3 Cg_exo . . . . . 0 CA--C 1.527 0.171 0 CA-C-O 120.754 0.231 . . . . 0.94999999999999996 112.161 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 1.4 pp -138.77 158.16 30.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.296 -0.411 . . . . 1.9399999999999999 111.277 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 29.7 p -115.68 -46.35 2.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.273 -0.422 . . . . 1.1599999999999999 111.182 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -80.73 139.61 36.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 2.6899999999999999 110.706 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -153.26 175.4 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 121.022 0.439 . . . . 0.83999999999999997 111.452 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -130.88 126.54 36.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.798 -0.637 . . . . 0.84999999999999998 110.188 179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.608 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 9.1 p90 -96.74 165.2 12.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.808 0.337 . . . . 0.70999999999999996 111.057 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 819' ' ' GLN . . . . . 0.581 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 5.6 tp60 -103.28 113.31 26.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.099 0.475 . . . . 1.9099999999999999 110.576 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -78.96 170.3 16.9 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.556 -0.747 . . . . 1.8 110.941 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.7 9.8 3.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.128 -0.487 . . . . 1.6200000000000001 111.251 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -105.72 6.61 32.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 1.6499999999999999 111.024 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 67.28 57.31 9.5 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.791 -0.719 . . . . 0.88 112.469 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -170.29 131.34 0.96 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.946 0.403 . . . . 1.8600000000000001 110.662 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.422 ' HZ ' HG23 ' A' ' 780' ' ' ILE . 34.3 m-85 -72.21 131.21 42.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.882 -0.599 . . . . 0.64000000000000001 110.942 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.608 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -115.14 166.58 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 115.787 -0.642 . . . . 0.96999999999999997 111.086 -179.64 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.24 103.49 14.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 0.56000000000000005 110.618 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.0 tt -79.5 119.01 21.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.103 -0.499 . . . . 0.81000000000000005 110.916 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -65.58 -66.46 2.42 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.875 -0.678 . . . . 0.81000000000000005 112.775 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 830' ' ' SER . . . . . 0.448 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 2.5 m -167.54 -135.16 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 110.463 -0.199 . . . . 1.3100000000000001 110.463 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.448 ' H ' ' HB3' ' A' ' 830' ' ' SER . 1.0 OUTLIER -57.81 -22.46 47.56 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.801 0.334 . . . . 2.2000000000000002 110.941 179.797 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -68.1 -70.05 0.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 2.21 110.877 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.13 -13.91 20.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.35 -0.386 . . . . 0.72999999999999998 110.511 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.551 ' CE2' HD22 ' A' ' 794' ' ' LEU . 0.4 OUTLIER -80.06 -44.96 19.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.969 -0.56 . . . . 0.26000000000000001 109.941 179.249 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.688 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 18.7 m-80 -68.11 -30.19 69.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.08 -0.509 . . . . 1.98 110.061 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 65.1 t -76.39 -56.02 9.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.735 -0.666 . . . . 0.67000000000000004 110.325 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.28 -27.59 64.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.006 -0.543 . . . . 0.22 110.611 179.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.688 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 25.1 mtmt -69.21 -45.27 70.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.183 -0.462 . . . . 0.84999999999999998 110.171 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.99 -26.17 65.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.079 -0.509 . . . . 1.95 110.082 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 19.8 ttp -74.54 -35.32 63.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.632 -0.713 . . . . 0.29999999999999999 110.319 179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.877 HD11 HD23 ' A' ' 849' ' ' LEU . 18.7 mt -66.67 -55.94 12.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.056 -0.52 . . . . 0.46999999999999997 110.646 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -61.44 -20.3 62.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.038 -0.528 . . . . 0.48999999999999999 111.235 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.13 2.21 1.66 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 1.6799999999999999 110.403 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.441 ' H ' ' C ' ' A' ' 842' ' ' ALA . 54.0 m-80 -153.7 23.15 0.52 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.902 -0.59 . . . . 1.96 110.769 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.9 t30 59.24 21.59 9.77 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.076 -0.511 . . . . 1.99 111.036 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -82.85 142.09 31.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 2.2999999999999998 110.867 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 4.05 4.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 1.98 111.044 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.524 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 4.5 m-85 -104.0 126.17 50.92 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.24 -0.436 . . . . 1.0900000000000001 110.94 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.877 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -119.06 127.66 53.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 0.73999999999999999 111.116 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.581 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 17.2 m-20 -86.0 156.21 20.54 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.962 -0.563 . . . . 1.52 110.721 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 1.009 HD12 ' HB3' ' A' ' 781' ' ' PHE . 1.7 mt . . . . . 0 C--N 1.332 -0.158 0 CA-C-O 120.753 0.311 . . . . 1.04 111.835 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.494 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.756 0.313 . . . . 1.22 110.811 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.99 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.4 OUTLIER -151.82 93.92 1.91 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.497 -0.557 . . . . 0.93999999999999995 109.497 179.55 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.762 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.2 OUTLIER -97.89 99.92 11.26 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.608 -0.724 . . . . 0.67000000000000004 111.233 -178.917 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.492 HD11 ' HE2' ' A' ' 801' ' ' LYS . 0.4 OUTLIER -106.28 140.9 38.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.602 -0.726 . . . . 1.5700000000000001 110.572 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.47 113.77 12.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.076 0.465 . . . . 0.81000000000000005 110.489 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.419 HG11 ' HH2' ' A' ' 834' ' ' TRP . 32.7 m -106.1 -163.92 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.516 -0.766 . . . . 1.1799999999999999 111.152 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.452 ' HG2' HG12 ' A' ' 788' ' ' VAL . 0.2 OUTLIER -150.06 169.14 21.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.219 -0.446 . . . . 1.3999999999999999 111.132 -179.89 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.33 -10.34 59.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 2.8500000000000001 110.917 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 788' ' ' VAL . . . . . 0.452 HG12 ' HG2' ' A' ' 786' ' ' GLU . 2.6 p -97.64 -28.02 3.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.921 -0.581 . . . . 0.33000000000000002 110.719 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 21.2 m0 -53.36 119.06 4.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.759 -0.655 . . . . 0.29999999999999999 111.565 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.05 168.22 16.12 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.215 -0.661 . . . . 1.8899999999999999 109.215 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -53.4 -25.51 16.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.931 0.396 . . . . 0.63 110.199 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' A' ' 796' ' ' MET . 47.1 m-20 -79.97 -57.46 3.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.952 -0.567 . . . . 2.0499999999999998 109.688 178.55 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.01 -21.72 4.82 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.036 -0.727 . . . . 1.0700000000000001 109.036 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.489 HD13 ' N ' ' A' ' 795' ' ' ILE . 1.3 tm? -75.35 -76.44 0.15 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.827 -1.079 . . . . 0.93000000000000005 110.208 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.643 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 16.3 mm -45.52 -35.67 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.162 -0.926 . . . . 0.32000000000000001 112.072 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.634 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 20.7 mtt -67.91 -48.98 64.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.563 0.22 . . . . 1.53 110.715 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -56.55 -52.81 63.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.112 0.482 . . . . 0.38 109.965 179.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.516 ' O ' HG23 ' A' ' 802' ' ' ILE . 76.4 mt -56.93 -52.71 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.553 -0.749 . . . . 0.5 110.527 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.798 ' HA ' HG12 ' A' ' 802' ' ' ILE . 1.6 t-20 -53.2 -34.29 56.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.412 -0.813 . . . . 0.81000000000000005 111.372 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 13.3 t -69.18 -30.47 68.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.337 -0.392 . . . . 0.97999999999999998 110.941 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 801' ' ' LYS . . . . . 0.492 ' HE2' HD11 ' A' ' 783' ' ' LEU . 10.1 mptt -88.38 -18.42 28.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 2.25 111.42 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.798 HG12 ' HA ' ' A' ' 799' ' ' ASN . 0.9 OUTLIER -94.8 -23.84 5.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.716 0.293 . . . . 0.75 111.355 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 803' ' ' SER . . . . . 0.42 ' N ' HG13 ' A' ' 802' ' ' ILE . 94.9 p . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.345 -0.389 . . . . 1.53 110.9 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 812' ' ' PRO . . . . . 0.483 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 31.2 Cg_exo . . . . . 0 CA--C 1.528 0.19 0 CA-C-O 120.779 0.241 . . . . 0.94999999999999996 112.456 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.405 HG12 HD13 ' A' ' 802' ' ' ILE . 14.3 mm -115.7 153.91 17.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.123 -0.49 . . . . 1.9399999999999999 110.904 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -124.08 -68.67 0.85 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.437 -0.347 . . . . 1.1599999999999999 111.462 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.78 129.77 34.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.309 -0.405 . . . . 2.6899999999999999 110.794 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.5 pp -144.75 -178.22 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.211 -0.45 . . . . 0.83999999999999997 111.409 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.459 ' O ' ' HA ' ' A' ' 851' ' ' ILE . 15.6 mmtt -121.79 149.92 42.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.983 -0.553 . . . . 0.84999999999999998 110.488 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 0.9 OUTLIER -130.98 165.05 24.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.364 . . . . 0.70999999999999996 111.299 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.05 109.13 21.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.947 -0.57 . . . . 1.9099999999999999 111.086 -179.252 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -79.12 167.31 21.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.566 -0.743 . . . . 1.8 110.53 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -70.06 -0.0 6.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.351 -0.386 . . . . 1.6200000000000001 111.443 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.68 13.61 33.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.446 -0.343 . . . . 1.6499999999999999 110.94 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 57.56 57.84 17.71 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.754 -0.736 . . . . 0.88 112.167 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -169.2 131.29 1.2 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 1.8600000000000001 110.708 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.496 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 57.9 m-85 -75.19 134.92 41.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.916 -0.584 . . . . 0.64000000000000001 110.974 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 826' ' ' VAL . . . . . . . . . . . . . 11.7 m -128.26 -177.91 2.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.96999999999999997 110.69 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 2.0 t -99.08 103.41 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.025 0.441 . . . . 0.56000000000000005 111.74 -179.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.478 ' HG ' ' HB3' ' A' ' 833' ' ' ASP . 8.7 tt -107.54 137.64 45.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.764 -0.653 . . . . 0.81000000000000005 110.379 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -179.76 32.92 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.269 -0.967 . . . . 0.81000000000000005 113.148 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.47 150.68 30.67 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.877 0.339 . . . . 1.3100000000000001 110.529 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -51.55 -21.93 2.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.014 0.435 . . . . 2.2000000000000002 110.386 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.52 ' O ' HG23 ' A' ' 836' ' ' VAL . 27.5 tt0 -71.6 -61.76 1.66 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.585 . . . . 2.21 110.967 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 833' ' ' ASP . . . . . 0.478 ' HB3' ' HG ' ' A' ' 828' ' ' LEU . 0.6 OUTLIER -63.45 -17.94 63.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.812 0.339 . . . . 0.72999999999999998 110.157 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.522 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.8 t-105 -82.4 -42.11 19.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.142 -0.481 . . . . 0.26000000000000001 110.425 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.753 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 16.6 m-80 -71.0 -30.87 67.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.098 0.475 . . . . 1.98 110.185 179.18 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 832' ' ' GLU . 91.2 t -75.74 -53.55 15.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.838 -0.619 . . . . 0.67000000000000004 110.011 179.274 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.84 -26.12 61.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.057 -0.519 . . . . 0.22 110.492 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.753 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 34.3 mtmt -72.46 -42.71 64.67 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.191 -0.459 . . . . 0.84999999999999998 110.32 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -64.38 -26.39 68.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.963 -0.562 . . . . 1.95 110.305 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 9.3 ttp -74.76 -39.26 61.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.791 -0.64 . . . . 0.29999999999999999 110.443 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.677 HD11 HD23 ' A' ' 849' ' ' LEU . 63.4 mt -64.49 -42.72 95.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.46999999999999997 110.845 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.0 -28.66 69.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.223 -0.444 . . . . 0.48999999999999999 111.074 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -70.61 6.94 1.23 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 1.6799999999999999 110.58 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.434 ' H ' ' C ' ' A' ' 842' ' ' ALA . 37.0 m-80 -148.1 14.76 1.03 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.042 -0.526 . . . . 1.96 110.911 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 59.19 18.22 6.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 1.99 111.14 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 846' ' ' GLU . . . . . 0.47 ' HB3' HD22 ' A' ' 841' ' ' LEU . 1.7 mm-40 -79.27 169.88 17.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.34 -0.391 . . . . 2.2999999999999998 110.936 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.8 10.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 1.98 111.195 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.762 ' HB3' HG22 ' A' ' 782' ' ' THR . 49.9 m-85 -117.23 131.68 56.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.821 0.343 . . . . 1.0900000000000001 110.629 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.677 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -110.5 123.74 50.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.73999999999999999 111.027 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -83.15 141.35 32.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.125 -0.489 . . . . 1.52 110.949 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.99 HD12 ' HB3' ' A' ' 781' ' ' PHE . 1.2 mt . . . . . 0 C--N 1.333 -0.11 0 CA-C-N 116.498 -0.319 . . . . 1.04 111.821 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.745 0.307 . . . . 1.22 111.053 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 1.082 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -149.0 89.44 1.67 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.509 -0.552 . . . . 0.93999999999999995 109.509 179.778 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.56 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -97.53 102.2 13.9 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.911 -0.586 . . . . 0.67000000000000004 111.341 -178.889 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.54 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 8.9 mp -89.48 -176.37 5.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.544 -0.753 . . . . 1.5700000000000001 110.637 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.77 95.04 5.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.829 -0.623 . . . . 0.81000000000000005 109.523 178.541 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.59 HG11 ' CZ2' ' A' ' 834' ' ' TRP . 93.8 t -92.76 146.52 6.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.347 -0.842 . . . . 1.1799999999999999 111.683 -178.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.405 ' HB3' HG12 ' A' ' 788' ' ' VAL . 0.1 OUTLIER -102.41 171.04 7.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.817 -0.629 . . . . 1.3999999999999999 110.629 179.688 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.32 53.55 2.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 2.8500000000000001 110.858 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 788' ' ' VAL . . . . . 0.405 HG12 ' HB3' ' A' ' 786' ' ' GLU . 2.7 p -163.35 -22.97 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.981 -0.554 . . . . 0.33000000000000002 110.87 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 36.6 m0 -57.07 129.55 42.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.766 -0.652 . . . . 0.29999999999999999 112.118 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.16 166.9 11.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.707 -0.849 . . . . 1.8899999999999999 108.707 178.15 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -54.58 -23.36 16.51 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.746 -0.382 . . . . 0.63 110.076 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.594 ' O ' ' HG3' ' A' ' 796' ' ' MET . 10.0 t70 -73.24 -58.36 3.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.912 -0.585 . . . . 2.0499999999999998 109.919 178.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.39 -33.47 69.66 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 116.265 -0.425 . . . . 1.0700000000000001 110.334 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.536 HD22 ' CE2' ' A' ' 834' ' ' TRP . 24.7 tp -61.56 -51.74 67.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.832 -0.622 . . . . 0.93000000000000005 110.07 179.325 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.696 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 17.8 mm -57.76 -31.47 40.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.54 -0.755 . . . . 0.32000000000000001 111.252 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.594 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.4 mtp -67.4 -52.19 42.82 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.7 0.286 . . . . 1.53 110.504 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.5 -53.51 50.5 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.172 -0.467 . . . . 0.38 110.241 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.458 ' O ' HG23 ' A' ' 802' ' ' ILE . 70.3 mt -58.76 -50.16 80.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.772 -0.649 . . . . 0.5 110.768 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.696 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.1 t-20 -55.59 -27.91 52.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.702 -0.681 . . . . 0.81000000000000005 111.248 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 46.9 t -78.62 -26.14 45.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.354 -0.385 . . . . 0.97999999999999998 110.743 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 801' ' ' LYS . . . . . 0.502 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -97.65 -2.03 42.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 2.25 111.298 -179.824 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.729 HD13 HG12 ' A' ' 813' ' ' ILE . 1.0 OUTLIER -113.89 -34.2 2.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.733 0.301 . . . . 0.75 111.399 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 803' ' ' SER . . . . . 0.5 ' N ' HG13 ' A' ' 802' ' ' ILE . 14.7 p . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 1.53 111.159 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo . . . . . 0 C--O 1.231 0.152 0 CA-C-O 120.786 0.244 . . . . 0.94999999999999996 112.011 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.729 HG12 HD13 ' A' ' 802' ' ' ILE . 7.5 pt -132.86 -175.96 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 1.9399999999999999 111.148 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.84 -67.43 0.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.416 -0.357 . . . . 1.1599999999999999 111.465 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -79.58 119.36 22.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.421 -0.354 . . . . 2.6899999999999999 110.852 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 816' ' ' ILE . . . . . 0.618 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -133.81 177.4 7.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.071 0.463 . . . . 0.83999999999999997 111.562 -179.591 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 15.1 mmtt -115.47 166.64 11.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.668 -0.696 . . . . 0.84999999999999998 110.111 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.593 ' CE1' HG23 ' A' ' 826' ' ' VAL . 9.3 p90 -151.58 157.98 42.91 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.042 0.449 . . . . 0.70999999999999996 111.459 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 819' ' ' GLN . . . . . 0.557 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 1.6 tt0 -82.78 107.13 15.18 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.819 -0.628 . . . . 1.9099999999999999 110.733 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.415 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 12.8 t0 -78.69 178.17 8.07 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.6 -0.727 . . . . 1.8 110.67 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.28 35.49 0.33 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.412 -0.358 . . . . 1.6200000000000001 111.155 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.66 11.96 4.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 1.6499999999999999 110.608 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 823' ' ' GLY . . . . . 0.502 ' HA2' HE21 ' A' ' 819' ' ' GLN . . . 61.5 47.34 91.22 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.822 -0.704 . . . . 0.88 112.219 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -171.12 133.97 0.9 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.991 0.424 . . . . 1.8600000000000001 110.615 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.489 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 95.2 m-85 -64.12 145.21 56.32 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.891 -0.595 . . . . 0.64000000000000001 110.784 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.593 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.5 OUTLIER -132.97 177.5 7.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 0.96999999999999997 110.682 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -99.03 110.39 26.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.886 0.374 . . . . 0.56000000000000005 111.181 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.561 HD12 ' HB3' ' A' ' 833' ' ' ASP . 6.0 tp -79.93 113.84 18.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.904 -0.589 . . . . 0.81000000000000005 110.625 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -59.76 -68.88 1.47 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.934 -0.651 . . . . 0.81000000000000005 112.594 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 830' ' ' SER . . . . . 0.482 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.3 OUTLIER -171.41 -142.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.475 0.178 . . . . 1.3100000000000001 110.538 -179.834 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.482 ' H ' ' HB3' ' A' ' 830' ' ' SER . 10.3 t70 -55.18 -22.61 18.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.69 0.281 . . . . 2.2000000000000002 110.943 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 832' ' ' GLU . . . . . 0.576 ' O ' HG23 ' A' ' 836' ' ' VAL . 49.2 mt-10 -68.41 -70.85 0.24 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.383 -0.372 . . . . 2.21 110.737 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 833' ' ' ASP . . . . . 0.561 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.6 OUTLIER -60.0 -13.34 10.92 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.385 -0.37 . . . . 0.72999999999999998 110.584 179.563 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.59 ' CZ2' HG11 ' A' ' 785' ' ' VAL . 1.0 OUTLIER -79.86 -45.3 18.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.243 -0.435 . . . . 0.26000000000000001 110.014 179.172 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -67.94 -33.28 74.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.924 -0.58 . . . . 1.98 110.224 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 836' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 832' ' ' GLU . 15.7 t -73.92 -52.0 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-N 115.887 -0.597 . . . . 0.67000000000000004 109.879 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.97 -26.77 62.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.97 -0.559 . . . . 0.22 110.139 178.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.506 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 0.9 OUTLIER -67.79 -45.97 73.27 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.869 -0.605 . . . . 0.84999999999999998 110.348 179.513 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 839' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 0.0 OUTLIER -62.51 -27.76 69.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.1 -0.5 . . . . 1.95 110.225 179.486 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 10.3 ttp -72.21 -36.69 69.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.873 -0.603 . . . . 0.29999999999999999 110.419 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.685 HD11 HD23 ' A' ' 849' ' ' LEU . 3.5 mt -73.92 -47.67 36.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.84 -0.618 . . . . 0.46999999999999997 110.833 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.429 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -63.21 -24.45 67.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.065 -0.516 . . . . 0.48999999999999999 111.047 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 843' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 14.9 tt0 -65.64 -0.02 1.88 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 1.6799999999999999 110.46 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.429 ' H ' ' C ' ' A' ' 842' ' ' ALA . 9.7 m120 -145.67 17.82 1.47 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.916 -0.584 . . . . 1.96 110.681 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 4.0 m120 59.05 29.79 19.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.5 . . . . 1.99 110.887 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -84.34 156.82 21.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 2.2999999999999998 110.831 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -149.13 13.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 1.98 110.995 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.54 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 79.9 m-85 -116.46 116.19 27.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 1.0900000000000001 110.765 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.685 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -109.44 125.94 52.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.49 . . . . 0.73999999999999999 111.246 -179.615 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.557 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 9.6 m-20 -79.69 160.64 26.21 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.91 -0.587 . . . . 1.52 111.062 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 1.082 HD12 ' HB3' ' A' ' 781' ' ' PHE . 17.7 mt . . . . . 0 C--N 1.333 -0.119 0 CA-C-N 116.49 -0.323 . . . . 1.04 111.628 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.494 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.856 0.36 . . . . 1.22 111.101 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 0.542 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -149.06 87.02 1.52 Allowed 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.272 -0.422 . . . . 0.93999999999999995 110.194 179.803 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -98.58 109.93 22.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.872 -0.604 . . . . 0.67000000000000004 111.31 -179.416 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 783' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -115.47 -167.99 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.861 -0.609 . . . . 1.5700000000000001 110.726 179.862 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.6 104.28 10.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.956 -0.566 . . . . 0.81000000000000005 110.161 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 34.7 m -96.7 175.58 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.035 -0.53 . . . . 1.1799999999999999 111.206 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.66 162.68 26.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.066 -0.516 . . . . 1.3999999999999999 110.764 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.69 2.95 10.67 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.291 -0.413 . . . . 2.8500000000000001 110.889 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.3 p -109.71 -22.9 4.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.521 . . . . 0.33000000000000002 110.689 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -59.17 123.64 17.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.77 -0.65 . . . . 0.29999999999999999 111.902 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 790' ' ' ASN . . . . . 0.731 HD21 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -96.49 159.76 14.76 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.854 -0.795 . . . . 1.8899999999999999 108.854 178.188 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.422 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 52.0 t80 -42.68 -34.6 0.93 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.646 0.26 . . . . 0.63 111.29 -178.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.731 ' HB3' HD21 ' A' ' 790' ' ' ASN . 3.7 t0 -68.85 -55.78 10.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.835 -0.432 . . . . 2.0499999999999998 109.835 178.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 793' ' ' ASP . . . . . 0.595 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 1.0 OUTLIER -56.08 -25.4 45.29 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.218 0.532 . . . . 1.0700000000000001 109.961 179.078 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.575 HD22 ' CE2' ' A' ' 834' ' ' TRP . 37.0 tp -71.93 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.396 -0.82 . . . . 0.93000000000000005 110.241 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.658 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 42.2 mm -55.46 -28.17 22.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.565 -0.743 . . . . 0.32000000000000001 111.541 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.612 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 14.6 mtp -68.26 -50.95 50.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.652 0.263 . . . . 1.53 110.45 179.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -55.52 -53.46 56.15 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.026 0.441 . . . . 0.38 110.041 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 64.3 mt -56.75 -49.74 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.807 -0.633 . . . . 0.5 110.557 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.658 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 2.4 t30 -54.66 -28.26 45.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.7 -0.682 . . . . 0.81000000000000005 111.273 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 35.9 t -78.32 -27.1 47.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.41 -0.359 . . . . 0.97999999999999998 110.985 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -99.29 0.87 43.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 2.25 111.439 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.595 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.7 pp -117.34 -32.14 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.696 0.284 . . . . 0.75 111.397 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 64.0 p . . . . . 0 C--N 1.329 -0.285 0 CA-C-O 120.922 0.391 . . . . 1.53 110.981 -179.721 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 C--O 1.232 0.198 0 CA-C-O 120.738 0.224 . . . . 0.94999999999999996 112.426 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.754 HD13 ' H ' ' A' ' 813' ' ' ILE . 0.2 OUTLIER -114.02 172.94 3.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 1.9399999999999999 111.079 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 31.2 p -126.85 -48.44 1.5 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 1.1599999999999999 111.158 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.5 mptt -80.69 132.05 35.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 2.6899999999999999 110.772 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.1 pp -147.33 174.19 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.43 . . . . 0.83999999999999997 111.166 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.456 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 16.1 mmtt -120.44 145.33 47.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.038 -0.528 . . . . 0.84999999999999998 110.752 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.607 ' CE1' HG23 ' A' ' 826' ' ' VAL . 6.0 p90 -124.72 168.54 13.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.70999999999999996 110.996 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -91.38 107.76 19.42 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.042 -0.526 . . . . 1.9099999999999999 110.798 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 820' ' ' ASP . . . . . 0.41 ' HB2' HG22 ' A' ' 826' ' ' VAL . 3.9 t70 -78.73 168.87 19.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.691 -0.686 . . . . 1.8 110.641 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 821' ' ' GLU . . . . . 0.405 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.6 OUTLIER -71.48 4.24 3.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.243 -0.435 . . . . 1.6200000000000001 111.361 -179.626 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -99.88 17.0 21.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.398 -0.365 . . . . 1.6499999999999999 110.742 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 55.9 50.51 60.83 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.848 -0.691 . . . . 0.88 112.333 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -172.97 134.6 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.928 0.394 . . . . 1.8600000000000001 110.454 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.548 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 69.3 m-85 -65.76 140.01 58.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.022 -0.536 . . . . 0.64000000000000001 110.666 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.607 HG23 ' CE1' ' A' ' 818' ' ' TYR . 3.1 m -132.48 177.24 7.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 0.96999999999999997 110.589 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.67 116.17 40.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.049 0.452 . . . . 0.56000000000000005 111.447 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.55 HD12 ' HB3' ' A' ' 833' ' ' ASP . 3.7 tp -79.76 108.05 13.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.682 -0.69 . . . . 0.81000000000000005 110.631 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -53.22 -67.14 2.28 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.928 -0.653 . . . . 0.81000000000000005 112.705 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 830' ' ' SER . . . . . 0.448 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 5.7 p -170.93 -141.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.488 -0.19 . . . . 1.3100000000000001 110.488 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.448 ' H ' ' HB2' ' A' ' 830' ' ' SER . 0.9 OUTLIER -56.32 -23.82 39.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.764 0.316 . . . . 2.2000000000000002 110.874 179.788 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.17 -67.94 0.41 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.445 . . . . 2.21 110.674 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 833' ' ' ASP . . . . . 0.55 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.2 OUTLIER -63.05 -13.29 33.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.345 -0.389 . . . . 0.72999999999999998 110.318 179.492 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.575 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.6 t-105 -80.46 -40.8 25.55 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.716 -0.476 . . . . 0.26000000000000001 109.716 178.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.402 ' HA ' ' HE2' ' A' ' 838' ' ' LYS . 31.4 m-80 -76.49 -26.67 55.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.803 -0.635 . . . . 1.98 110.132 178.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -79.4 -42.76 23.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.831 -0.622 . . . . 0.67000000000000004 109.737 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.19 71.32 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.159 0.504 . . . . 0.22 109.823 178.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 0.6 OUTLIER -66.7 -48.22 69.94 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.631 -0.713 . . . . 0.84999999999999998 110.447 179.416 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -60.15 -27.63 67.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.066 -0.516 . . . . 1.95 110.512 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 840' ' ' MET . . . . . 0.405 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 8.0 ttp -72.89 -38.21 67.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.952 -0.567 . . . . 0.29999999999999999 110.487 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.875 HD11 HD23 ' A' ' 849' ' ' LEU . 7.8 mt -72.77 -18.03 61.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.46999999999999997 110.905 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.433 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.92 -29.21 44.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.48999999999999999 111.339 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.11 1.08 1.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 1.6799999999999999 110.752 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.433 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.1 OUTLIER -144.82 13.31 1.49 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 1.96 110.855 -179.965 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 58.4 18.83 5.89 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.156 -0.475 . . . . 1.99 111.065 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.25 166.66 23.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 2.2999999999999998 110.901 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.16 16.38 0.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 1.98 111.02 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.486 ' HB3' HG22 ' A' ' 782' ' ' THR . 68.6 m-85 -112.48 113.11 25.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 1.0900000000000001 110.723 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.875 HD23 HD11 ' A' ' 841' ' ' LEU . 0.2 OUTLIER -100.9 130.58 46.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.73999999999999999 110.937 -179.75 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.45 ' C ' HG12 ' A' ' 851' ' ' ILE . 3.7 m-20 -96.11 153.98 17.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.187 -0.461 . . . . 1.52 111.324 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 0.542 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.332 -0.16 0 CA-C-N 116.069 -0.514 . . . . 1.04 111.066 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.766 0.317 . . . . 1.22 110.881 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 781' ' ' PHE . . . . . 1.043 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.3 OUTLIER -142.09 83.65 1.85 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.665 -0.494 . . . . 0.93999999999999995 109.665 179.586 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 782' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.9 OUTLIER -98.12 123.44 42.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.743 -0.662 . . . . 0.67000000000000004 111.43 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.78 -165.54 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.693 -0.685 . . . . 1.5700000000000001 110.699 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 784' ' ' LEU . . . . . 0.415 HD12 ' HG3' ' A' ' 847' ' ' LYS . 0.4 OUTLIER -117.1 104.17 10.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.184 -0.462 . . . . 0.81000000000000005 110.271 179.499 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.531 HG21 ' HH2' ' A' ' 834' ' ' TRP . 33.8 m -97.66 -174.75 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.963 -0.562 . . . . 1.1799999999999999 111.59 -179.099 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 786' ' ' GLU . . . . . 0.423 ' HG2' HG12 ' A' ' 788' ' ' VAL . 1.1 tt0 -139.22 162.37 35.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.925 -0.58 . . . . 1.3999999999999999 110.759 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 787' ' ' LYS . . . . . 0.464 ' HA ' ' HD2' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -70.92 -7.95 49.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 2.8500000000000001 111.001 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 788' ' ' VAL . . . . . 0.423 HG12 ' HG2' ' A' ' 786' ' ' GLU . 3.0 p -100.33 -25.92 3.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.989 -0.551 . . . . 0.33000000000000002 110.955 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -56.29 121.91 10.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.955 -0.566 . . . . 0.29999999999999999 111.739 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -90.98 165.56 13.48 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.865 -0.791 . . . . 1.8899999999999999 108.865 178.226 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 791' ' ' PHE . . . . . 0.44 ' O ' HG12 ' A' ' 795' ' ' ILE . 53.3 t80 -52.04 -27.51 13.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.986 0.422 . . . . 0.63 110.089 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 792' ' ' ASP . . . . . 0.635 ' O ' ' HG3' ' A' ' 796' ' ' MET . 11.5 m-20 -69.43 -59.71 2.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.568 . . . . 2.0499999999999998 109.815 178.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.14 -32.91 62.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.149 -0.478 . . . . 1.0700000000000001 110.261 179.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.485 HD22 ' CE2' ' A' ' 834' ' ' TRP . 34.1 tp -62.41 -54.37 41.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.809 -0.632 . . . . 0.93000000000000005 110.0 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 795' ' ' ILE . . . . . 0.669 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 31.3 mm -58.02 -31.53 41.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.42 -0.809 . . . . 0.32000000000000001 111.696 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 796' ' ' MET . . . . . 0.635 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 20.3 mtt -65.94 -47.8 73.48 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.965 -0.294 . . . . 1.53 110.814 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -56.54 -55.54 32.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.104 0.478 . . . . 0.38 109.903 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 88.6 mt -55.48 -52.49 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.644 -0.707 . . . . 0.5 110.628 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 799' ' ' ASN . . . . . 0.669 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t30 -55.57 -32.14 62.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.609 -0.723 . . . . 0.81000000000000005 111.538 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.76 -19.3 57.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.887 0.375 . . . . 0.97999999999999998 110.868 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 801' ' ' LYS . . . . . 0.489 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.1 OUTLIER -106.93 -0.69 22.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.114 -0.494 . . . . 2.25 111.478 -179.907 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 802' ' ' ILE . . . . . 0.597 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.9 pp -119.49 -25.42 2.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.755 0.312 . . . . 0.75 111.511 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 93.0 p . . . . . 0 C--N 1.33 -0.267 0 CA-C-O 120.972 0.415 . . . . 1.53 111.082 -179.815 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo . . . . . 0 C--O 1.231 0.153 0 CA-C-O 120.864 0.277 . . . . 0.94999999999999996 112.285 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 813' ' ' ILE . . . . . 0.421 HG13 HD13 ' A' ' 802' ' ' ILE . 1.2 pp -133.13 -175.78 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 1.9399999999999999 111.201 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.02 -50.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 1.1599999999999999 111.111 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -99.3 117.41 33.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.265 -0.425 . . . . 2.6899999999999999 110.909 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 816' ' ' ILE . . . . . 0.598 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -135.62 178.9 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.109 -0.496 . . . . 0.83999999999999997 111.28 -179.917 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 817' ' ' LYS . . . . . 0.715 ' HE2' HG13 ' A' ' 827' ' ' VAL . 19.5 mttt -117.92 163.71 16.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.955 -0.566 . . . . 0.84999999999999998 110.295 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 818' ' ' TYR . . . . . 0.652 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 20.1 p90 -132.93 158.6 42.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.881 0.372 . . . . 0.70999999999999996 111.145 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 819' ' ' GLN . . . . . 0.727 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -96.2 108.02 20.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.18 0.514 . . . . 1.9099999999999999 110.327 179.811 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -79.33 174.82 11.18 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.564 -0.744 . . . . 1.8 110.882 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 821' ' ' GLU . . . . . 0.411 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.1 OUTLIER -81.8 40.28 0.59 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.101 -0.5 . . . . 1.6200000000000001 111.116 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -140.11 11.76 2.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 1.6499999999999999 110.618 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 61.69 56.23 24.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.83 -0.7 . . . . 0.88 112.338 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -169.99 132.96 1.14 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.956 0.408 . . . . 1.8600000000000001 110.82 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 825' ' ' PHE . . . . . 0.48 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 77.0 m-85 -77.43 129.04 35.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.886 -0.597 . . . . 0.64000000000000001 110.958 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 826' ' ' VAL . . . . . 0.652 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 0.9 OUTLIER -107.65 167.69 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 116.106 -0.497 . . . . 0.96999999999999997 111.057 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 827' ' ' VAL . . . . . 0.715 HG13 ' HE2' ' A' ' 817' ' ' LYS . 0.2 OUTLIER -99.67 104.48 16.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.267 -0.424 . . . . 0.56000000000000005 111.055 179.856 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 2.2 tt -80.21 125.64 30.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.035 -0.53 . . . . 0.81000000000000005 110.782 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -81.31 -56.59 2.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.784 -0.722 . . . . 0.81000000000000005 112.775 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 50.6 p -171.28 -141.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.415 -0.217 . . . . 1.3100000000000001 110.415 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 10.4 p-10 -57.58 -15.43 7.34 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.648 0.261 . . . . 2.2000000000000002 110.908 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -68.48 -76.32 0.09 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.313 -0.403 . . . . 2.21 110.699 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -11.49 17.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.34 -0.391 . . . . 0.72999999999999998 110.365 179.541 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 834' ' ' TRP . . . . . 0.531 ' HH2' HG21 ' A' ' 785' ' ' VAL . 1.4 t-105 -79.95 -38.53 32.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.138 0.494 . . . . 0.26000000000000001 109.931 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 835' ' ' ASN . . . . . 0.701 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -76.14 -34.28 59.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.768 -0.651 . . . . 1.98 110.005 179.018 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -72.18 -43.93 65.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.484 -0.78 . . . . 0.67000000000000004 109.861 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -69.0 -25.25 64.42 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.207 -0.451 . . . . 0.22 110.115 178.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 838' ' ' LYS . . . . . 0.701 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 30.3 mtmt -72.91 -40.9 65.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.958 -0.565 . . . . 0.84999999999999998 110.066 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 -64.68 -31.48 72.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.97 -0.559 . . . . 1.95 110.039 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 840' ' ' MET . . . . . 0.411 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 10.2 ttp -67.81 -38.96 83.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.829 -0.623 . . . . 0.29999999999999999 110.14 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 841' ' ' LEU . . . . . 0.965 HD11 HD23 ' A' ' 849' ' ' LEU . 47.1 mt -69.61 -37.68 76.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.82 -0.627 . . . . 0.46999999999999997 110.725 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 842' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -67.8 -29.69 68.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.48999999999999999 111.083 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -67.31 1.89 1.95 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.114 -0.493 . . . . 1.6799999999999999 110.614 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 844' ' ' ASN . . . . . 0.406 ' H ' ' C ' ' A' ' 842' ' ' ALA . 13.6 m120 -142.76 17.18 1.98 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 1.96 110.928 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 4.8 m120 59.51 15.87 4.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.177 -0.465 . . . . 1.99 111.041 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -79.75 166.25 21.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 2.2999999999999998 110.85 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 847' ' ' LYS . . . . . 0.415 ' HG3' HD12 ' A' ' 784' ' ' LEU . 0.0 OUTLIER -157.01 12.46 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 1.98 110.949 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 848' ' ' PHE . . . . . 0.411 ' HB3' ' CG2' ' A' ' 782' ' ' THR . 5.2 m-85 -108.3 127.63 54.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 1.0900000000000001 110.973 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 849' ' ' LEU . . . . . 0.965 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -118.28 128.98 55.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.151 -0.477 . . . . 0.73999999999999999 110.973 -179.798 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 850' ' ' ASN . . . . . 0.727 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 2.6 m-80 -89.22 167.32 13.19 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.948 -0.569 . . . . 1.52 111.313 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 851' ' ' ILE . . . . . 1.043 HD12 ' HB3' ' A' ' 781' ' ' PHE . 53.3 mt . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.404 -0.362 . . . . 1.04 111.314 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.126 0 N-CA-C 112.447 -0.261 . . . . 9.0999999999999996 112.447 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -92.11 -0.24 57.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.763 0.316 . . . . 8.1199999999999992 111.218 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 73.9 mmm -90.31 -42.25 11.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 8.3399999999999999 111.035 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 90.11 111.18 1.42 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.761 -0.733 . . . . 4.25 112.493 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 779' ' ' SER . . . . . 0.432 ' HB2' HD12 ' A' ' 853' ' ' LEU . 0.6 OUTLIER -128.96 163.02 26.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.827 0.346 . . . . 2.6099999999999999 111.055 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.507 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 1.1 mt -120.84 165.02 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 1.22 110.927 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.759 ' HB2' ' HB ' ' A' ' 851' ' ' ILE . 0.7 OUTLIER -143.39 84.72 1.82 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.268 -0.423 . . . . 0.93999999999999995 110.366 179.735 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.624 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.2 OUTLIER -98.0 103.28 15.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.905 -0.589 . . . . 0.67000000000000004 110.6 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.717 HD22 ' HE2' ' A' ' 801' ' ' LYS . 0.1 OUTLIER -112.56 -166.44 1.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.626 -0.715 . . . . 1.5700000000000001 110.732 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.79 112.06 19.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.056 -0.52 . . . . 0.81000000000000005 110.035 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 10.1 m -103.67 157.1 5.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.998 -0.546 . . . . 1.1799999999999999 111.138 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.548 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 4.1 tp10 -102.8 170.45 7.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 1.3999999999999999 110.978 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 787' ' ' LYS . . . . . 0.548 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.4 OUTLIER -83.65 27.04 0.64 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 2.8500000000000001 110.6 179.752 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -136.58 -25.44 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.932 -0.576 . . . . 0.33000000000000002 110.57 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -52.6 123.15 10.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.702 -0.681 . . . . 0.29999999999999999 111.939 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.98 166.03 12.9 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.733 -0.84 . . . . 1.8899999999999999 108.733 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.495 ' O ' HG12 ' A' ' 795' ' ' ILE . 93.0 t80 -52.71 -28.46 22.05 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.693 -0.403 . . . . 0.63 110.165 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.515 ' O ' ' HG3' ' A' ' 796' ' ' MET . 14.6 t70 -68.75 -56.24 8.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.07 -0.514 . . . . 2.0499999999999998 109.702 178.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 793' ' ' ASP . . . . . 0.459 ' HA ' ' HG3' ' A' ' 796' ' ' MET . 1.2 t0 -57.44 -33.05 67.52 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.969 -0.56 . . . . 1.0700000000000001 110.232 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.51 HD22 ' CE2' ' A' ' 834' ' ' TRP . 30.5 tp -63.69 -53.16 55.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.864 -0.607 . . . . 0.93000000000000005 109.91 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.66 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 35.8 mm -56.62 -27.01 24.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.645 -0.707 . . . . 0.32000000000000001 111.23 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.515 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 10.5 mtp -67.66 -46.95 70.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.724 0.297 . . . . 1.53 110.458 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 797' ' ' ALA . . . . . 0.439 ' O ' ' HD3' ' A' ' 801' ' ' LYS . . . -56.87 -53.68 55.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.037 0.446 . . . . 0.38 109.935 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.529 HD11 HD12 ' A' ' 851' ' ' ILE . 75.4 mt -57.95 -51.44 70.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.746 -0.661 . . . . 0.5 110.616 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.66 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t-20 -56.27 -26.96 53.65 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.519 -0.764 . . . . 0.81000000000000005 111.325 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 800' ' ' SER . . . . . 0.506 ' HA ' ' HB2' ' A' ' 804' ' ' ASN . 0.1 OUTLIER -80.11 -23.47 41.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.317 -0.401 . . . . 0.97999999999999998 110.614 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 801' ' ' LYS . . . . . 0.717 ' HE2' HD22 ' A' ' 783' ' ' LEU . 0.5 OUTLIER -101.08 -1.67 33.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.952 -0.567 . . . . 2.25 111.179 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.673 HD13 HG12 ' A' ' 813' ' ' ILE . 1.4 pp -117.14 -29.42 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.453 -0.34 . . . . 0.75 111.349 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 803' ' ' SER . . . . . 0.515 ' HB2' HD12 ' A' ' 802' ' ' ILE . 0.5 OUTLIER -166.03 85.05 0.32 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.283 -0.417 . . . . 1.53 110.871 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 804' ' ' ASN . . . . . 0.506 ' HB2' ' HA ' ' A' ' 800' ' ' SER . 8.6 t-20 -122.01 -17.07 7.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.475 . . . . 2.8300000000000001 110.925 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.05 134.36 33.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 4.2000000000000002 111.212 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -101.82 103.15 13.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 7.6900000000000004 110.888 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -118.09 -70.53 0.79 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.051 -0.522 . . . . 6.2199999999999998 110.765 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -132.63 -73.47 0.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.058 -0.519 . . . . 6.8300000000000001 110.678 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -130.91 136.87 48.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.907 -0.588 . . . . 6.4100000000000001 110.628 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 1.6 pt -121.54 160.57 22.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 4.7800000000000002 111.418 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.21 95.14 10.64 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 1.8 110.689 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.83 -176.29 2.27 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.556 2.171 . . . . 0.94999999999999996 112.486 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.673 HG12 HD13 ' A' ' 802' ' ' ILE . 4.4 pt -145.05 171.87 5.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.122 -0.49 . . . . 1.9399999999999999 110.931 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 3.2 p -144.57 -53.81 0.32 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.319 -0.401 . . . . 1.1599999999999999 111.271 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -81.98 114.92 20.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 2.6899999999999999 110.767 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 816' ' ' ILE . . . . . 0.595 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -136.08 169.27 20.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.232 -0.44 . . . . 0.83999999999999997 111.318 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 8.9 mttt -110.58 166.68 10.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.025 -0.534 . . . . 0.84999999999999998 110.421 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.571 ' CE1' HG23 ' A' ' 826' ' ' VAL . 10.6 p90 -149.77 152.94 36.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.973 0.416 . . . . 0.70999999999999996 111.377 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 819' ' ' GLN . . . . . 0.41 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -76.74 108.01 9.45 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.933 -0.576 . . . . 1.9099999999999999 110.672 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.544 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.0 t70 -78.97 179.3 7.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.383 -0.826 . . . . 1.8 110.792 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.71 35.96 0.53 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 1.6200000000000001 111.051 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.33 16.27 3.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.32 -0.4 . . . . 1.6499999999999999 110.999 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 60.98 46.45 94.55 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.787 -0.721 . . . . 0.88 112.319 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -174.02 134.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.972 0.415 . . . . 1.8600000000000001 110.65 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.421 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 72.5 m-85 -65.7 144.97 56.58 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.944 -0.571 . . . . 0.64000000000000001 110.766 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.571 HG23 ' CE1' ' A' ' 818' ' ' TYR . 1.0 OUTLIER -130.03 179.56 4.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.96999999999999997 110.903 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.7 113.57 33.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.981 0.42 . . . . 0.56000000000000005 111.397 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.97 131.5 34.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.804 -0.634 . . . . 0.81000000000000005 110.725 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -76.76 -68.52 1.51 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.723 -0.751 . . . . 0.81000000000000005 112.669 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 90.7 p -170.17 -137.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.38 -0.23 . . . . 1.3100000000000001 110.38 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -54.45 -27.93 40.81 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.907 0.384 . . . . 2.2000000000000002 110.65 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.544 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.9 OUTLIER -63.92 -68.41 0.35 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.08 -0.509 . . . . 2.21 110.882 179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -11.28 28.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.3 -0.409 . . . . 0.72999999999999998 110.674 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.516 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.5 t-105 -82.86 -41.65 18.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.26000000000000001 110.176 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 54.9 m-20 -73.42 -27.33 61.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.048 -0.524 . . . . 1.98 110.001 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 832' ' ' GLU . 51.0 t -78.84 -51.42 17.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.771 -0.65 . . . . 0.67000000000000004 109.928 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.45 66.34 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.991 -0.55 . . . . 0.22 110.314 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.428 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 1.7 mtpp -67.16 -49.34 65.09 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.877 -0.602 . . . . 0.84999999999999998 110.467 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.88 -24.77 66.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 1.95 110.334 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.9 ttp -75.56 -34.05 60.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.84 -0.618 . . . . 0.29999999999999999 110.37 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.805 HD11 HD23 ' A' ' 849' ' ' LEU . 27.8 mt -69.98 -47.42 62.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.915 -0.584 . . . . 0.46999999999999997 110.803 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.53 -3.64 44.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.48999999999999999 111.404 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -3.49 2.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.971 0.415 . . . . 1.6799999999999999 110.171 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.416 ' H ' ' C ' ' A' ' 842' ' ' ALA . 1.5 m120 -145.35 -73.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.771 -0.649 . . . . 1.96 110.322 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -179.26 27.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.833 -0.622 . . . . 1.99 110.921 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.22 142.96 30.98 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.291 -0.413 . . . . 2.2999999999999998 110.913 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -132.91 -16.65 2.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.947 -0.569 . . . . 1.98 110.698 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.624 ' HB3' HG22 ' A' ' 782' ' ' THR . 32.7 m-85 -84.46 144.9 28.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.171 -0.468 . . . . 1.0900000000000001 111.133 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.805 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -124.42 131.19 53.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.935 -0.575 . . . . 0.73999999999999999 110.516 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.446 ' C ' HG12 ' A' ' 851' ' ' ILE . 7.3 m-80 -89.87 153.58 20.53 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.885 -0.598 . . . . 1.52 111.185 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.759 ' HB ' ' HB2' ' A' ' 781' ' ' PHE . 1.5 mm -137.12 159.0 36.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 116.123 -0.49 . . . . 1.04 111.413 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.425 ' N ' HG22 ' A' ' 851' ' ' ILE . 0.3 OUTLIER -128.16 163.88 23.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.818 0.342 . . . . 5.0899999999999999 110.782 179.669 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 853' ' ' LEU . . . . . 0.432 HD12 ' HB2' ' A' ' 779' ' ' SER . 32.5 mt -128.69 78.01 1.82 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 2.6000000000000001 110.852 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.233 -0.889 . . . . 3.3900000000000001 110.903 179.949 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.51 -0.236 . . . . 9.0999999999999996 112.51 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -89.83 175.95 7.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.773 0.32 . . . . 8.1199999999999992 111.14 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.53 148.65 40.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 8.3399999999999999 110.818 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -133.1 -152.48 6.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.648 -0.787 . . . . 4.25 112.492 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 779' ' ' SER . . . . . 0.471 ' O ' ' HB3' ' A' ' 853' ' ' LEU . 0.0 OUTLIER -148.51 -169.99 3.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.723 0.297 . . . . 2.6099999999999999 111.047 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.53 -172.6 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 1.22 110.949 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 1.001 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.3 OUTLIER -153.77 92.05 1.52 Allowed 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.053 0.454 . . . . 0.93999999999999995 110.006 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.561 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -97.43 97.93 9.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.736 -0.666 . . . . 0.67000000000000004 110.89 -179.349 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.5 OUTLIER -91.56 146.73 23.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.595 -0.73 . . . . 1.5700000000000001 111.086 -179.671 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.78 108.98 12.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.404 . . . . 0.81000000000000005 110.555 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 847' ' ' LYS . 17.3 m -98.48 -166.6 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.898 -0.592 . . . . 1.1799999999999999 111.371 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.582 ' HG2' HG12 ' A' ' 788' ' ' VAL . 0.8 OUTLIER -140.37 171.55 13.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.278 -0.419 . . . . 1.3999999999999999 111.003 -179.856 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.03 20.15 2.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 2.8500000000000001 110.853 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 788' ' ' VAL . . . . . 0.582 HG12 ' HG2' ' A' ' 786' ' ' GLU . 1.7 p -136.18 -26.33 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.777 -0.647 . . . . 0.33000000000000002 110.72 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 24.5 m0 -51.92 126.63 18.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.935 -0.575 . . . . 0.29999999999999999 111.848 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.11 168.67 10.96 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.051 -0.722 . . . . 1.8899999999999999 109.051 178.313 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.407 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 69.8 t80 -54.4 -24.75 21.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.011 0.434 . . . . 0.63 110.06 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.654 ' O ' ' HG3' ' A' ' 796' ' ' MET . 26.3 t0 -73.19 -61.78 1.7 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.803 -0.635 . . . . 2.0499999999999998 109.851 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -54.01 -27.35 31.31 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.159 -0.473 . . . . 1.0700000000000001 110.045 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.576 HD22 ' CE2' ' A' ' 834' ' ' TRP . 32.1 tp -68.55 -58.12 4.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.783 -0.644 . . . . 0.93000000000000005 110.403 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.7 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 19.9 mm -56.86 -32.24 38.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.521 -0.763 . . . . 0.32000000000000001 111.647 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.654 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.5 mtt -66.81 -52.87 38.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.7 0.286 . . . . 1.53 110.601 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.89 -54.94 31.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.022 0.439 . . . . 0.38 110.192 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 46.6 mt -56.26 -48.77 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.763 -0.653 . . . . 0.5 110.52 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.7 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.2 t-20 -57.96 -23.84 55.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.871 -0.604 . . . . 0.81000000000000005 111.099 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.81 -24.21 38.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.031 0.444 . . . . 0.97999999999999998 110.316 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 801' ' ' LYS . . . . . 0.519 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -101.85 -2.34 30.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.766 -0.652 . . . . 2.25 111.297 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.57 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.8 pp -121.2 -25.11 2.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.79 0.328 . . . . 0.75 111.414 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 44.1 t -133.6 11.43 4.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.285 -0.416 . . . . 1.53 110.825 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 56.74 -163.61 0.17 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.064 -0.516 . . . . 2.8300000000000001 111.035 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 1.9 p -83.79 -27.59 28.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 4.2000000000000002 110.985 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -113.18 139.39 48.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 7.6900000000000004 110.828 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -98.18 110.39 22.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 6.2199999999999998 111.072 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -110.47 63.55 0.61 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.507 . . . . 6.8300000000000001 110.717 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 57.35 55.5 5.77 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.048 -0.524 . . . . 6.4100000000000001 110.854 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -116.68 -11.6 11.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.096 -0.502 . . . . 4.7800000000000002 111.042 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 59.79 94.87 0.05 OUTLIER Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.992 -0.549 . . . . 1.8 111.134 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.18 -169.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.819 2.346 . . . . 0.94999999999999996 112.269 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 42.2 pt -136.22 154.68 33.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.9 0.381 . . . . 1.9399999999999999 111.436 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 9.8 p -133.44 -64.23 0.73 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.969 -0.559 . . . . 1.1599999999999999 110.824 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.44 123.38 32.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.486 . . . . 2.6899999999999999 110.31 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 816' ' ' ILE . . . . . 0.825 HG22 ' HD3' ' A' ' 852' ' ' ARG . 1.7 pp -144.65 174.14 3.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.066 0.46 . . . . 0.83999999999999997 111.89 -179.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.78 ' H ' ' HG2' ' A' ' 852' ' ' ARG . 5.4 mmtp -105.54 172.94 6.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.649 -0.705 . . . . 0.84999999999999998 110.32 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.576 ' CE1' HG23 ' A' ' 826' ' ' VAL . 9.0 p90 -158.03 163.01 38.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.932 0.396 . . . . 0.70999999999999996 111.421 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 819' ' ' GLN . . . . . 0.491 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -82.32 107.59 15.11 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.902 -0.59 . . . . 1.9099999999999999 110.713 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.446 ' HB3' HG22 ' A' ' 826' ' ' VAL . 0.2 OUTLIER -79.02 -178.76 6.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.479 -0.782 . . . . 1.8 110.795 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -82.86 38.61 0.59 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.294 -0.412 . . . . 1.6200000000000001 111.284 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -140.16 9.1 2.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.34 -0.391 . . . . 1.6499999999999999 110.848 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 65.1 49.08 63.96 Favored Glycine 0 C--N 1.331 0.258 0 C-N-CA 120.682 -0.771 . . . . 0.88 112.287 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -169.29 134.3 1.5 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.982 0.42 . . . . 1.8600000000000001 110.617 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.511 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 94.5 m-85 -63.69 136.03 57.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.881 -0.599 . . . . 0.64000000000000001 110.871 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.576 HG23 ' CE1' ' A' ' 818' ' ' TYR . 3.0 m -126.46 179.15 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 0.96999999999999997 110.595 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.93 114.53 36.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.954 0.407 . . . . 0.56000000000000005 111.537 -179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 4.8 tp -83.17 122.44 28.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.809 -0.632 . . . . 0.81000000000000005 110.86 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.29 -75.36 0.48 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.783 -0.722 . . . . 0.81000000000000005 112.619 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -161.75 -141.97 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 110.499 -0.186 . . . . 1.3100000000000001 110.499 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -59.41 -16.39 22.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.729 0.3 . . . . 2.2000000000000002 110.84 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.553 ' O ' HG23 ' A' ' 836' ' ' VAL . 29.1 mt-10 -75.05 -66.32 0.77 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.235 -0.439 . . . . 2.21 110.613 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -61.59 -15.15 36.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.285 -0.416 . . . . 0.72999999999999998 110.263 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.576 ' CE2' HD22 ' A' ' 794' ' ' LEU . 2.8 t-105 -82.37 -39.27 22.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.26000000000000001 109.59 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.721 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -69.61 -37.74 76.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.86 -0.609 . . . . 1.98 109.751 178.776 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 832' ' ' GLU . 24.3 t -69.88 -54.65 18.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.557 -0.747 . . . . 0.67000000000000004 109.675 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.97 -24.72 40.14 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.855 -0.612 . . . . 0.22 110.324 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.721 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 27.8 mtmt -71.88 -45.49 61.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.835 -0.62 . . . . 0.84999999999999998 110.317 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -65.22 -17.64 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.835 -0.621 . . . . 1.95 110.349 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 6.2 ttp -83.46 -33.85 25.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.683 -0.69 . . . . 0.29999999999999999 110.403 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.911 HD11 HD23 ' A' ' 849' ' ' LEU . 20.5 mt -68.84 -45.79 70.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.46999999999999997 110.898 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -64.88 -28.14 69.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.48999999999999999 111.407 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.81 8.26 0.93 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.227 -0.442 . . . . 1.6799999999999999 110.74 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.434 ' H ' ' C ' ' A' ' 842' ' ' ALA . 11.2 m-80 -146.53 16.56 1.29 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.018 -0.537 . . . . 1.96 110.802 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 59.93 19.6 8.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.051 -0.522 . . . . 1.99 111.128 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 846' ' ' GLU . . . . . 0.438 ' HB3' HD22 ' A' ' 841' ' ' LEU . 3.2 mt-10 -83.5 170.85 13.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.422 -0.354 . . . . 2.2999999999999998 110.654 179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 847' ' ' LYS . . . . . 0.487 ' O ' HG22 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -152.07 -30.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.425 -0.352 . . . . 1.98 111.273 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.462 ' HB3' ' HB ' ' A' ' 782' ' ' THR . 4.1 m-85 -82.4 143.09 31.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.918 0.39 . . . . 1.0900000000000001 111.041 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.911 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -122.29 121.33 36.5 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.04 -0.527 . . . . 0.73999999999999999 110.744 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.491 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 4.6 m-20 -75.45 161.65 29.03 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.993 -0.549 . . . . 1.52 111.327 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 1.001 HD12 ' HB3' ' A' ' 781' ' ' PHE . 6.0 mt -133.44 165.01 33.43 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.104 0 CA-C-N 116.184 -0.462 . . . . 1.04 111.025 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.825 ' HD3' HG22 ' A' ' 816' ' ' ILE . 1.4 ptm180 -44.84 -86.52 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.458 -0.337 . . . . 5.0899999999999999 111.684 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 853' ' ' LEU . . . . . 0.471 ' HB3' ' O ' ' A' ' 779' ' ' SER . 0.4 OUTLIER 53.85 26.46 6.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.415 -0.357 . . . . 2.6000000000000001 111.034 -179.69 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 24.2 p90 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.129 -0.939 . . . . 3.3900000000000001 110.86 179.952 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.532 -0.227 . . . . 9.0999999999999996 112.532 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -122.53 -22.3 5.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.776 0.322 . . . . 8.1199999999999992 111.054 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 5.4 mtt -95.95 -39.76 9.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 8.3399999999999999 110.991 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 89.57 116.22 1.58 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.833 -0.699 . . . . 4.25 112.291 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 43.6 p -92.53 132.83 36.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.871 0.367 . . . . 2.6099999999999999 111.139 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.496 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -109.43 -178.64 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.155 -0.475 . . . . 1.22 110.855 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.659 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.37 97.45 1.23 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.985 0.422 . . . . 0.93999999999999995 109.911 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.526 HG23 ' OD1' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -96.86 94.14 7.07 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.297 0.57 . . . . 0.67000000000000004 110.765 -179.438 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.445 ' HA ' HD22 ' A' ' 783' ' ' LEU . 0.2 OUTLIER -92.16 114.65 27.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.42 -0.809 . . . . 1.5700000000000001 111.036 -179.489 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.486 HD12 ' HE1' ' A' ' 848' ' ' PHE . 6.8 tt -62.12 103.99 0.43 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.072 -0.513 . . . . 0.81000000000000005 110.535 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.445 HG21 ' HH2' ' A' ' 834' ' ' TRP . 26.3 m -98.4 -172.0 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.979 -0.555 . . . . 1.1799999999999999 111.413 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.43 176.27 8.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.138 -0.483 . . . . 1.3999999999999999 110.882 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.98 35.46 0.79 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.097 0.475 . . . . 2.8500000000000001 110.806 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.0 p -150.77 -28.38 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.674 -0.694 . . . . 0.33000000000000002 110.896 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 23.3 m0 -49.06 124.24 8.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.826 -0.624 . . . . 0.29999999999999999 111.736 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.66 166.66 12.68 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.142 -0.688 . . . . 1.8899999999999999 109.142 178.346 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.433 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 77.2 t80 -52.83 -24.1 8.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.944 0.402 . . . . 0.63 110.172 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.656 ' O ' ' HG3' ' A' ' 796' ' ' MET . 2.1 t70 -72.25 -62.49 1.42 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.868 -0.605 . . . . 2.0499999999999998 109.697 178.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -53.63 -27.02 24.71 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 116.158 -0.474 . . . . 1.0700000000000001 110.356 179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.627 HD22 ' CE2' ' A' ' 834' ' ' TRP . 26.9 tp -70.19 -54.34 13.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.858 -0.61 . . . . 0.93000000000000005 110.478 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.687 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 23.5 mm -59.23 -34.1 52.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.654 -0.703 . . . . 0.32000000000000001 111.868 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.656 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 21.8 mtm -71.17 -43.4 67.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.636 0.255 . . . . 1.53 111.067 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.95 79.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.272 0.558 . . . . 0.38 109.975 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.474 ' O ' HG23 ' A' ' 802' ' ' ILE . 48.1 mt -62.94 -47.8 91.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.446 -0.797 . . . . 0.5 110.281 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.742 ' HA ' HG12 ' A' ' 802' ' ' ILE . 0.8 OUTLIER -56.13 -29.58 60.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.846 -0.616 . . . . 0.81000000000000005 111.133 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.84 -29.49 58.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.97999999999999998 110.848 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 801' ' ' LYS . . . . . 0.539 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -94.41 -3.93 49.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 2.25 111.467 -179.77 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.742 HG12 ' HA ' ' A' ' 799' ' ' ASN . 7.0 pt -113.76 -22.15 5.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.761 0.315 . . . . 0.75 111.244 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.29 92.03 0.54 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.258 -0.428 . . . . 1.53 111.006 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -103.14 -13.25 16.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 2.8300000000000001 110.8 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -114.61 159.81 20.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 4.2000000000000002 110.968 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -110.29 164.27 12.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.439 . . . . 7.6900000000000004 110.86 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 55.26 69.9 0.69 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.088 -0.505 . . . . 6.2199999999999998 110.888 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -119.42 -66.72 1.04 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.115 -0.493 . . . . 6.8300000000000001 110.836 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -167.25 -41.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.455 . . . . 6.4100000000000001 110.921 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 4.6 pt -130.65 177.79 6.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.167 -0.469 . . . . 4.7800000000000002 111.164 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.45 154.77 37.01 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.047 -0.524 . . . . 1.8 110.88 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -51.1 156.31 5.25 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.612 2.208 . . . . 0.94999999999999996 112.484 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 4.4 mm -107.61 148.7 11.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 1.9399999999999999 111.092 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 82.1 p -115.94 -47.2 2.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.25 -0.432 . . . . 1.1599999999999999 111.374 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.94 139.18 30.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.266 -0.425 . . . . 2.6899999999999999 111.093 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -150.63 168.77 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.126 -0.488 . . . . 0.83999999999999997 111.169 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.638 ' HE2' HG13 ' A' ' 827' ' ' VAL . 14.6 mmtt -115.45 134.63 54.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 0.84999999999999998 110.646 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.602 ' CE1' HG23 ' A' ' 826' ' ' VAL . 5.4 p90 -113.33 168.48 9.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.893 0.378 . . . . 0.70999999999999996 111.26 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -93.68 105.99 17.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.975 -0.557 . . . . 1.9099999999999999 110.761 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.456 ' HB2' HG22 ' A' ' 826' ' ' VAL . 4.6 t0 -79.07 169.65 17.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.83 -0.623 . . . . 1.8 110.373 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.9 52.65 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.189 0.518 . . . . 1.6200000000000001 111.105 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 -141.05 1.5 1.65 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.679 -0.691 . . . . 1.6499999999999999 110.463 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 74.6 44.44 26.39 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.882 -0.675 . . . . 0.88 111.982 -179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -174.08 142.44 0.84 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 121.164 0.507 . . . . 1.8600000000000001 110.57 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.438 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 70.6 m-85 -72.25 147.26 46.64 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.625 -0.716 . . . . 0.64000000000000001 110.462 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.602 HG23 ' CE1' ' A' ' 818' ' ' TYR . 2.4 m -137.48 177.92 5.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.305 -0.407 . . . . 0.96999999999999997 110.726 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 827' ' ' VAL . . . . . 0.638 HG13 ' HE2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -98.93 118.65 45.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.019 0.438 . . . . 0.56000000000000005 111.35 -179.626 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.457 HD12 ' HB3' ' A' ' 833' ' ' ASP . 3.5 tp -79.75 113.67 18.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.767 -0.651 . . . . 0.81000000000000005 110.745 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -58.01 -71.75 0.7 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.995 -0.621 . . . . 0.81000000000000005 112.751 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 57.4 p -171.07 -136.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.502 0.191 . . . . 1.3100000000000001 110.732 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.459 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 0.7 OUTLIER -57.85 -20.59 37.44 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.771 0.32 . . . . 2.2000000000000002 110.967 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.487 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.5 OUTLIER -72.62 -68.29 0.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.428 . . . . 2.21 110.947 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 833' ' ' ASP . . . . . 0.457 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.6 OUTLIER -60.9 -13.35 15.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.72999999999999998 110.793 179.776 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.627 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.5 t-105 -86.26 -40.38 15.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.9 0.381 . . . . 0.26000000000000001 110.111 179.281 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.743 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -68.91 -37.09 78.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.95 -0.568 . . . . 1.98 109.885 179.064 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 832' ' ' GLU . 39.9 t -72.25 -54.47 16.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.462 -0.79 . . . . 0.67000000000000004 110.149 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.01 -25.48 61.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.0 -0.545 . . . . 0.22 110.601 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.743 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 23.8 mtmt -69.73 -42.67 73.66 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.169 -0.469 . . . . 0.84999999999999998 110.191 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 839' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 5.0 mt-10 -68.11 -25.93 65.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.061 -0.518 . . . . 1.95 110.161 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 12.4 ttp -74.97 -35.72 62.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.746 -0.661 . . . . 0.29999999999999999 110.497 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.646 HD11 HD23 ' A' ' 849' ' ' LEU . 15.4 mt -67.69 -49.21 63.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.46999999999999997 110.917 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 842' ' ' ALA . . . . . . . . . . . . . . . -80.46 -0.34 36.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.48999999999999999 111.544 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 843' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 0.5 OUTLIER -66.43 -0.86 2.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.998 0.428 . . . . 1.6799999999999999 110.377 179.466 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 844' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -149.74 -71.2 0.19 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.847 -0.615 . . . . 1.96 110.63 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -177.82 26.33 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.959 -0.564 . . . . 1.99 111.162 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -100.62 140.93 34.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.824 0.345 . . . . 2.2999999999999998 110.876 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.3 2.84 2.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 1.98 110.931 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.486 ' HE1' HD12 ' A' ' 784' ' ' LEU . 0.5 OUTLIER -111.02 126.03 54.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.358 -0.383 . . . . 1.0900000000000001 110.947 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.646 HD23 HD11 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -97.37 133.32 42.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.083 -0.508 . . . . 0.73999999999999999 110.697 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.526 ' OD1' HG23 ' A' ' 782' ' ' THR . 6.5 m-20 -85.59 153.93 22.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 1.52 111.197 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.659 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.4 mm -136.65 162.18 35.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.202 -0.454 . . . . 1.04 111.096 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.58 ' HB3' ' HD1' ' A' ' 854' ' ' TYR . 0.0 OUTLIER -111.46 -44.58 3.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.49 -0.323 . . . . 5.0899999999999999 110.759 179.732 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 2.1 mt 57.99 24.55 11.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.025 -0.534 . . . . 2.6000000000000001 111.074 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 854' ' ' TYR . . . . . 0.58 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 2.0 p90 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.224 -0.894 . . . . 3.3900000000000001 110.983 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 N-CA-C 112.526 -0.229 . . . . 9.0999999999999996 112.526 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -89.39 86.82 6.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.76 0.314 . . . . 8.1199999999999992 111.275 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 55.3 70.63 0.61 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.082 -0.508 . . . . 8.3399999999999999 111.209 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -87.29 158.57 30.21 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.853 -0.689 . . . . 4.25 112.304 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.66 -173.66 4.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 2.6099999999999999 111.013 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.45 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -127.1 -160.09 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.022 -0.535 . . . . 1.22 110.719 179.927 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.706 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -133.59 78.44 1.77 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.112 0.482 . . . . 0.93999999999999995 110.113 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.1 OUTLIER -98.46 115.7 29.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.67000000000000004 111.378 -179.401 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.51 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -116.9 -167.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.709 -0.678 . . . . 1.5700000000000001 110.672 179.832 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -116.34 110.92 19.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.028 -0.533 . . . . 0.81000000000000005 110.372 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.639 HG21 ' HH2' ' A' ' 834' ' ' TRP . 28.8 m -107.45 158.57 7.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 1.1799999999999999 111.539 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.618 ' HG2' HG12 ' A' ' 788' ' ' VAL . 1.1 tt0 -110.18 171.06 7.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.983 -0.553 . . . . 1.3999999999999999 110.725 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -79.19 -9.36 59.54 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.039 0.447 . . . . 2.8500000000000001 110.783 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 788' ' ' VAL . . . . . 0.618 HG12 ' HG2' ' A' ' 786' ' ' GLU . 2.7 p -96.06 -24.26 4.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.785 -0.643 . . . . 0.33000000000000002 110.848 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -56.73 126.17 25.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.29999999999999999 111.931 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.85 167.94 10.79 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.009 -0.737 . . . . 1.8899999999999999 109.009 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.442 ' O ' HG12 ' A' ' 795' ' ' ILE . 80.6 t80 -54.67 -24.3 21.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.885 0.374 . . . . 0.63 110.069 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 796' ' ' MET . 24.1 m-20 -73.58 -57.6 3.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.979 -0.555 . . . . 2.0499999999999998 109.758 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.31 -30.5 64.8 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.166 -0.47 . . . . 1.0700000000000001 110.124 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.531 HD13 ' CZ2' ' A' ' 834' ' ' TRP . 30.2 tp -65.46 -54.72 24.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.712 -0.676 . . . . 0.93000000000000005 110.281 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.656 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 30.3 mm -57.25 -27.98 29.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.484 -0.78 . . . . 0.32000000000000001 111.535 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.5 mtt -68.18 -51.01 50.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.716 0.294 . . . . 1.53 110.548 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.04 -53.06 58.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.057 0.456 . . . . 0.38 109.911 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.469 HG21 HD11 ' A' ' 813' ' ' ILE . 74.2 mt -57.49 -53.02 49.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.643 -0.708 . . . . 0.5 110.428 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.656 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 2.5 t30 -54.96 -24.64 24.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.563 -0.744 . . . . 0.81000000000000005 111.283 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 800' ' ' SER . . . . . 0.534 ' HA ' ' HB2' ' A' ' 804' ' ' ASN . 42.1 t -78.79 -27.56 44.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.349 -0.387 . . . . 0.97999999999999998 110.537 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.41 4.6 36.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.985 -0.552 . . . . 2.25 111.358 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.568 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.0 OUTLIER -127.22 -23.63 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 111.933 0.346 . . . . 0.75 111.933 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 34.9 t -122.86 -28.73 4.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.729 0.299 . . . . 1.53 111.078 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 804' ' ' ASN . . . . . 0.534 ' HB2' ' HA ' ' A' ' 800' ' ' SER . 0.9 OUTLIER -94.5 137.59 33.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.306 -0.406 . . . . 2.8300000000000001 110.952 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 55.94 71.98 0.52 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.121 -0.491 . . . . 4.2000000000000002 111.277 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -130.69 -80.9 0.54 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.395 -0.366 . . . . 7.6900000000000004 110.901 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -146.4 -71.03 0.24 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.165 -0.471 . . . . 6.2199999999999998 110.858 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 808' ' ' ASN . . . . . 0.4 ' H ' ' H ' ' A' ' 809' ' ' ASN . 40.2 p-10 -173.34 0.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.213 -0.449 . . . . 6.8300000000000001 111.05 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 809' ' ' ASN . . . . . 0.4 ' H ' ' H ' ' A' ' 808' ' ' ASN . 0.3 OUTLIER -101.32 165.94 11.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.286 -0.415 . . . . 6.4100000000000001 111.022 -179.892 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 2.0 pt -133.55 122.5 43.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.099 -0.501 . . . . 4.7800000000000002 111.013 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 66.8 m -149.6 67.62 8.81 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.241 -0.436 . . . . 1.8 111.168 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.87 168.49 7.08 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.576 2.184 . . . . 0.94999999999999996 112.105 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.544 HG12 HD13 ' A' ' 802' ' ' ILE . 8.7 pt -140.93 -176.25 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.959 0.409 . . . . 1.9399999999999999 111.294 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 1.6 t -158.57 -40.42 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.97 -0.559 . . . . 1.1599999999999999 110.981 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.79 126.92 52.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.081 -0.509 . . . . 2.6899999999999999 110.821 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -155.27 -176.17 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 0.83999999999999997 111.365 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.82 ' H ' ' HB2' ' A' ' 852' ' ' ARG . 17.5 mmtt -108.64 169.67 8.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.84999999999999998 110.595 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.506 ' CE1' HG23 ' A' ' 826' ' ' VAL . 11.0 p90 -157.29 157.25 33.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.988 0.423 . . . . 0.70999999999999996 111.191 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 819' ' ' GLN . . . . . 0.513 ' HA ' ' O ' ' A' ' 824' ' ' ASP . 55.3 tt0 -76.33 102.15 5.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.897 -0.592 . . . . 1.9099999999999999 111.039 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.5 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.2 t0 -79.24 -176.01 4.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.587 -0.733 . . . . 1.8 110.627 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -81.79 15.13 2.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.362 -0.381 . . . . 1.6200000000000001 111.185 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.34 6.11 44.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.432 . . . . 1.6499999999999999 111.07 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 75.2 16.35 80.65 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.736 . . . . 0.88 112.482 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 824' ' ' ASP . . . . . 0.513 ' O ' ' HA ' ' A' ' 819' ' ' GLN . 2.8 t0 -143.49 -147.35 0.21 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.754 0.311 . . . . 1.8600000000000001 110.358 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.462 ' HB2' ' OH ' ' A' ' 854' ' ' TYR . 49.3 m-85 -129.02 150.89 50.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.295 -0.411 . . . . 0.64000000000000001 110.895 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.506 HG23 ' CE1' ' A' ' 818' ' ' TYR . 8.4 m -139.14 -178.58 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.96999999999999997 110.558 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -98.64 113.41 33.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.969 0.414 . . . . 0.56000000000000005 111.682 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -80.36 120.27 24.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.909 -0.587 . . . . 0.81000000000000005 110.63 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -68.48 -72.5 0.81 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.847 -0.692 . . . . 0.81000000000000005 112.621 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.79 -136.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.492 0.187 . . . . 1.3100000000000001 110.51 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -59.61 -16.26 24.52 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.702 0.287 . . . . 2.2000000000000002 110.822 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.532 ' O ' HG23 ' A' ' 836' ' ' VAL . 32.0 mt-10 -74.89 -70.4 0.41 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.284 -0.417 . . . . 2.21 110.827 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -61.77 -11.76 13.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.72999999999999998 110.841 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.639 ' HH2' HG21 ' A' ' 785' ' ' VAL . 2.0 t-105 -84.01 -40.7 18.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.891 0.377 . . . . 0.26000000000000001 110.17 179.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.719 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -69.07 -35.22 76.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 1.98 110.024 179.112 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 832' ' ' GLU . 13.2 t -74.71 -53.56 16.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.67000000000000004 110.132 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -56.57 -27.16 57.22 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.124 -0.489 . . . . 0.22 110.488 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.719 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 21.4 mtmt -68.55 -47.89 65.71 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.988 -0.551 . . . . 0.84999999999999998 110.336 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.97 -25.63 67.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.485 . . . . 1.95 110.27 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.7 ttp -73.05 -35.21 66.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.779 -0.646 . . . . 0.29999999999999999 110.269 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.716 HD11 HD23 ' A' ' 849' ' ' LEU . 6.0 mt -67.67 -50.76 56.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.825 -0.625 . . . . 0.46999999999999997 110.659 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.403 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.18 -2.28 36.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.11 -0.495 . . . . 0.48999999999999999 111.263 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.85 -4.92 2.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.001 0.429 . . . . 1.6799999999999999 110.211 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.403 ' H ' ' C ' ' A' ' 842' ' ' ALA . 3.1 m120 -147.67 -71.22 0.22 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.633 -0.712 . . . . 1.96 110.538 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 177.36 30.18 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.906 -0.588 . . . . 1.99 110.725 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 846' ' ' GLU . . . . . 0.621 ' HB3' HD23 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -96.0 142.16 28.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 2.2999999999999998 111.292 -179.602 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -136.49 -4.77 2.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.014 -0.539 . . . . 1.98 110.658 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.51 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 58.3 m-85 -91.33 136.26 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.957 -0.565 . . . . 1.0900000000000001 110.905 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.716 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -128.91 124.0 34.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.73999999999999999 111.122 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -85.46 169.14 13.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.075 -0.511 . . . . 1.52 110.851 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.706 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.0 OUTLIER -134.48 170.63 19.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.434 -0.348 . . . . 1.04 111.51 -179.699 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.82 ' HB2' ' H ' ' A' ' 817' ' ' LYS . 13.2 ttt180 -44.1 -82.55 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.134 -0.485 . . . . 5.0899999999999999 111.534 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 44.36 44.96 7.19 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.802 0.334 . . . . 2.6000000000000001 111.425 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 854' ' ' TYR . . . . . 0.687 ' HD2' ' HG3' ' A' ' 852' ' ' ARG . 13.2 m-85 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.293 -0.86 . . . . 3.3900000000000001 110.768 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.477 -0.249 . . . . 9.0999999999999996 112.477 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -153.08 136.19 15.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.758 0.313 . . . . 8.1199999999999992 111.036 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 2.6 ttm -138.43 139.71 39.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 8.3399999999999999 110.98 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 110.58 143.98 9.84 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.823 -0.703 . . . . 4.25 112.531 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 1.5 t -117.08 -175.67 2.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.76 0.314 . . . . 2.6099999999999999 110.958 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.09 -169.37 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.185 -0.462 . . . . 1.22 111.038 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.817 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.46 95.44 1.12 Allowed 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.999 0.428 . . . . 0.93999999999999995 110.077 179.744 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -97.54 89.33 4.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.997 -0.547 . . . . 0.67000000000000004 111.0 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.27 137.51 32.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 1.5700000000000001 110.682 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.486 HD12 ' CE1' ' A' ' 848' ' ' PHE . 0.6 OUTLIER -62.61 107.49 0.96 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.114 0.483 . . . . 0.81000000000000005 110.45 179.849 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.427 ' HB ' ' O ' ' A' ' 847' ' ' LYS . 17.6 t -96.29 136.04 28.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.497 -0.774 . . . . 1.1799999999999999 110.712 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -97.3 165.32 12.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 1.3999999999999999 110.969 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.01 51.1 2.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.069 -0.514 . . . . 2.8500000000000001 110.651 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 1.5 p -164.53 -28.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.882 -0.599 . . . . 0.33000000000000002 110.605 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 26.4 m0 -47.75 130.83 14.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.608 -0.724 . . . . 0.29999999999999999 112.035 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.82 168.28 10.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.831 -0.803 . . . . 1.8899999999999999 108.831 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -53.34 -24.14 11.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.005 0.431 . . . . 0.63 110.329 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.65 ' O ' ' HG3' ' A' ' 796' ' ' MET . 17.5 m-20 -76.85 -60.61 2.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.846 -0.615 . . . . 2.0499999999999998 109.66 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -55.14 -21.83 14.64 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-O 121.093 0.473 . . . . 1.0700000000000001 109.804 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.595 HD22 ' CE2' ' A' ' 834' ' ' TRP . 40.2 tp -73.81 -60.24 2.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.535 -0.757 . . . . 0.93000000000000005 110.365 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.672 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 19.0 mm -57.1 -36.65 52.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.394 -0.821 . . . . 0.32000000000000001 111.988 -179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.65 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.2 mtt -69.59 -39.44 77.3 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.68 0.276 . . . . 1.53 110.837 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -65.34 -50.77 64.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.211 0.529 . . . . 0.38 110.05 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.551 ' O ' HG23 ' A' ' 802' ' ' ILE . 31.0 mt -61.4 -48.26 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 115.495 -0.775 . . . . 0.5 110.349 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.672 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.9 OUTLIER -56.35 -34.79 66.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.765 -0.652 . . . . 0.81000000000000005 110.952 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.96 -24.07 60.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.266 -0.425 . . . . 0.97999999999999998 110.715 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 801' ' ' LYS . . . . . 0.583 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -99.29 -2.21 37.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.075 -0.511 . . . . 2.25 111.419 -179.887 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.578 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.3 pp -116.13 -22.91 4.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.718 0.294 . . . . 0.75 111.533 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 55.7 p -147.61 86.39 1.6 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.344 -0.389 . . . . 1.53 110.9 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -153.7 121.83 6.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.107 -0.497 . . . . 2.8300000000000001 110.855 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 55.2 79.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 4.2000000000000002 111.119 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 62.25 -83.06 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.954 -0.566 . . . . 7.6900000000000004 111.383 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 63.85 179.41 0.16 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.285 -0.416 . . . . 6.2199999999999998 110.852 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.73 -38.92 16.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.088 -0.505 . . . . 6.8300000000000001 110.949 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -72.28 158.52 35.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 6.4100000000000001 110.985 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -124.17 132.09 71.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 4.7800000000000002 111.101 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 14.7 t 64.71 143.5 0.08 OUTLIER Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 116.061 -0.518 . . . . 1.8 111.327 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -74.23 -173.13 1.34 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.437 2.092 . . . . 0.94999999999999996 112.395 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.548 HG12 HD13 ' A' ' 802' ' ' ILE . 5.5 pt -146.55 171.32 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.276 -0.42 . . . . 1.9399999999999999 111.07 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 19.4 p -128.82 -67.3 0.79 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.193 -0.458 . . . . 1.1599999999999999 111.129 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.3 mptt -83.51 137.84 33.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 2.6899999999999999 110.736 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 816' ' ' ILE . . . . . 0.692 HG22 ' HD3' ' A' ' 852' ' ' ARG . 0.9 OUTLIER -152.03 -178.18 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.296 -0.411 . . . . 0.83999999999999997 111.603 -179.749 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.904 ' HB2' ' HB3' ' A' ' 852' ' ' ARG . 6.8 mmtt -120.24 155.02 34.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.86 -0.609 . . . . 0.84999999999999998 110.691 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.62 ' CE1' HG23 ' A' ' 826' ' ' VAL . 5.2 p90 -136.47 174.29 10.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.468 -0.333 . . . . 0.70999999999999996 111.133 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -96.09 106.58 18.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.213 -0.449 . . . . 1.9099999999999999 111.043 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.444 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 5.7 t70 -79.31 173.3 12.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.8 -0.637 . . . . 1.8 110.938 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -79.21 33.55 0.23 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.224 -0.444 . . . . 1.6200000000000001 111.19 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -128.85 8.88 5.77 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.225 -0.443 . . . . 1.6499999999999999 110.554 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 64.22 51.89 48.93 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.86 -0.686 . . . . 0.88 112.414 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -176.03 141.13 0.44 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.146 0.498 . . . . 1.8600000000000001 110.598 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.547 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 58.9 m-85 -66.73 145.25 55.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.636 -0.711 . . . . 0.64000000000000001 110.747 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.62 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.9 OUTLIER -138.51 178.1 4.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 0.96999999999999997 110.824 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 827' ' ' VAL . . . . . 0.501 HG13 ' HE2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -99.1 116.46 42.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.0 0.428 . . . . 0.56000000000000005 111.326 -179.736 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 4.3 tp -82.33 108.17 15.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.8 -0.636 . . . . 0.81000000000000005 110.876 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -58.09 -69.38 1.3 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.863 -0.684 . . . . 0.81000000000000005 112.691 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 830' ' ' SER . . . . . 0.471 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 3.0 p -170.07 -143.42 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 110.497 -0.186 . . . . 1.3100000000000001 110.497 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.471 ' H ' ' HB2' ' A' ' 830' ' ' SER . 20.2 t70 -56.48 -19.17 14.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.716 0.293 . . . . 2.2000000000000002 110.831 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -70.47 -68.49 0.42 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.356 -0.384 . . . . 2.21 110.552 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.33 -12.22 28.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.399 -0.364 . . . . 0.72999999999999998 110.357 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.595 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.0 OUTLIER -82.68 -44.41 15.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.061 -0.518 . . . . 0.26000000000000001 110.363 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -35.25 80.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.049 -0.523 . . . . 1.98 109.947 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.11 -54.6 14.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.546 -0.752 . . . . 0.67000000000000004 110.079 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.82 -26.52 46.84 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.095 -0.502 . . . . 0.22 110.506 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 838' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -67.42 -50.13 60.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.075 -0.511 . . . . 0.84999999999999998 110.277 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -58.64 -24.5 61.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.938 -0.574 . . . . 1.95 110.136 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 6.7 ttp -74.86 -36.4 62.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.691 -0.686 . . . . 0.29999999999999999 110.444 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 17.0 mt -60.7 -43.23 98.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.082 -0.508 . . . . 0.46999999999999997 110.433 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.43 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -74.3 -27.39 60.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.545 . . . . 0.48999999999999999 111.181 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.35 7.63 0.99 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.048 -0.524 . . . . 1.6799999999999999 110.708 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 842' ' ' ALA . 24.1 m-80 -148.04 17.2 1.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.062 -0.517 . . . . 1.96 110.714 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.7 t30 60.22 12.59 3.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.17 -0.468 . . . . 1.99 110.872 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.16 171.01 15.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.973 -0.558 . . . . 2.2999999999999998 111.142 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 847' ' ' LYS . . . . . 0.427 ' O ' ' HB ' ' A' ' 785' ' ' VAL . 0.0 OUTLIER -152.21 -37.12 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.628 -0.714 . . . . 1.98 110.244 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.486 ' CE1' HD12 ' A' ' 784' ' ' LEU . 9.8 m-85 -83.49 147.14 27.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.019 -0.537 . . . . 1.0900000000000001 110.783 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.6 OUTLIER -123.38 132.63 54.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.219 -0.446 . . . . 0.73999999999999999 111.026 179.74 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 29.4 m-20 -85.65 154.15 21.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 1.52 110.936 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.817 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -121.43 169.05 13.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.21 -0.45 . . . . 1.04 111.047 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.904 ' HB3' ' HB2' ' A' ' 817' ' ' LYS . 1.6 ptm180 -53.74 -95.16 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.309 -0.405 . . . . 5.0899999999999999 111.475 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 7.6 mp 54.45 22.75 4.03 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.407 -0.36 . . . . 2.6000000000000001 111.213 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 7.1 p90 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.222 -0.894 . . . . 3.3900000000000001 110.995 179.946 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.183 0 N-CA-C 112.442 -0.263 . . . . 9.0999999999999996 112.442 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -95.02 -67.14 0.87 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.847 0.356 . . . . 8.1199999999999992 111.109 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 2.6 mtt -93.7 108.53 20.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 8.3399999999999999 110.754 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 169.97 92.88 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.681 -0.771 . . . . 4.25 112.745 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 2.3 p -97.73 9.59 42.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.888 0.375 . . . . 2.6099999999999999 110.793 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.43 -155.02 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.071 -0.513 . . . . 1.22 111.097 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.881 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.79 99.58 2.01 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 109.097 -0.705 . . . . 0.93999999999999995 109.097 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.591 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -96.46 94.87 7.65 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.723 -0.671 . . . . 0.67000000000000004 110.945 -178.851 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.504 HD11 ' HB1' ' A' ' 797' ' ' ALA . 0.2 OUTLIER -100.23 104.84 16.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.521 -0.763 . . . . 1.5700000000000001 110.872 -179.755 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.44 114.08 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.105 -0.498 . . . . 0.81000000000000005 110.567 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.482 HG11 ' CH2' ' A' ' 834' ' ' TRP . 30.7 m -103.41 179.55 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.451 -0.795 . . . . 1.1799999999999999 111.434 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.5 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 5.1 tp10 -122.97 176.7 5.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.968 -0.56 . . . . 1.3999999999999999 110.842 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 787' ' ' LYS . . . . . 0.5 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 2.5 mttt -90.0 54.96 2.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 2.8500000000000001 110.751 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.4 p -171.44 -27.97 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.107 -0.497 . . . . 0.33000000000000002 111.058 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -50.33 126.13 14.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.816 -0.629 . . . . 0.29999999999999999 112.086 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.89 167.93 11.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.708 -0.849 . . . . 1.8899999999999999 108.708 178.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.465 ' O ' HG12 ' A' ' 795' ' ' ILE . 87.4 t80 -54.51 -27.15 36.11 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.659 -0.416 . . . . 0.63 110.179 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.58 ' O ' ' HG3' ' A' ' 796' ' ' MET . 30.4 m-20 -70.71 -56.49 6.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.008 -0.542 . . . . 2.0499999999999998 109.622 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.96 -31.09 66.53 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.138 -0.483 . . . . 1.0700000000000001 110.279 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.608 HD22 ' CE2' ' A' ' 834' ' ' TRP . 31.7 tp -65.86 -54.48 26.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.826 -0.625 . . . . 0.93000000000000005 110.468 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.667 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 26.8 mm -54.11 -29.89 19.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.499 -0.773 . . . . 0.32000000000000001 111.744 -179.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.58 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.8 mtp -69.03 -51.59 37.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.558 0.218 . . . . 1.53 110.623 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 797' ' ' ALA . . . . . 0.504 ' HB1' HD11 ' A' ' 783' ' ' LEU . . . -54.27 -50.85 66.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.072 0.463 . . . . 0.38 110.157 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 802' ' ' ILE . 63.6 mt -60.3 -53.37 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.63 -0.714 . . . . 0.5 110.556 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.755 ' HA ' HG12 ' A' ' 802' ' ' ILE . 5.8 t-20 -54.33 -27.24 34.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.482 -0.781 . . . . 0.81000000000000005 111.458 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.11 -29.18 48.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.438 -0.346 . . . . 0.97999999999999998 111.099 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 801' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 801' ' ' LYS . 0.2 OUTLIER -93.14 -9.29 39.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.397 -0.365 . . . . 2.25 111.488 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.755 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.0 OUTLIER -100.75 -31.0 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.825 0.345 . . . . 0.75 111.278 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 803' ' ' SER . . . . . 0.483 ' N ' HG13 ' A' ' 802' ' ' ILE . 69.0 p -135.42 65.71 1.54 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.272 -0.422 . . . . 1.53 110.817 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -65.77 173.94 2.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.476 . . . . 2.8300000000000001 111.062 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 74.7 p -87.16 20.51 2.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 4.2000000000000002 111.019 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -76.04 -5.85 48.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.168 -0.469 . . . . 7.6900000000000004 110.854 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 17.9 t30 57.43 57.7 4.24 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.059 -0.519 . . . . 6.2199999999999998 110.836 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -144.73 4.4 1.14 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.092 -0.503 . . . . 6.8300000000000001 110.873 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -154.87 131.65 10.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.146 -0.479 . . . . 6.4100000000000001 110.858 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 29.7 pt -121.63 -179.41 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.426 . . . . 4.7800000000000002 111.183 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 56.13 81.22 0.26 Allowed Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 1.8 111.064 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -57.42 169.03 2.48 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.616 2.211 . . . . 0.94999999999999996 112.392 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.619 HG12 HD13 ' A' ' 802' ' ' ILE . 5.5 mm -119.6 161.78 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.038 -0.528 . . . . 1.9399999999999999 110.822 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 814' ' ' THR . . . . . 0.582 HG23 ' H ' ' A' ' 815' ' ' LYS . 0.0 OUTLIER -131.26 -62.23 0.89 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.54 -0.3 . . . . 1.1599999999999999 111.414 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 815' ' ' LYS . . . . . 0.582 ' H ' HG23 ' A' ' 814' ' ' THR . 0.0 OUTLIER -82.13 142.41 32.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.37 -0.377 . . . . 2.6899999999999999 110.869 -179.835 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -155.59 167.93 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.066 -0.516 . . . . 0.83999999999999997 111.267 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.458 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 19.2 mmtt -105.41 149.6 25.99 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.99 -0.55 . . . . 0.84999999999999998 110.572 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.641 ' CE1' HG23 ' A' ' 826' ' ' VAL . 6.2 p90 -131.13 169.3 16.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.764 0.316 . . . . 0.70999999999999996 111.356 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -92.14 107.08 18.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.071 -0.513 . . . . 1.9099999999999999 110.884 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.409 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 13.4 t70 -79.0 173.91 12.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.737 -0.665 . . . . 1.8 110.964 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 821' ' ' GLU . . . . . 0.605 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 12.4 pt-20 -71.02 0.92 6.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.244 -0.434 . . . . 1.6200000000000001 111.439 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.61 13.79 32.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.399 -0.364 . . . . 1.6499999999999999 110.796 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 55.58 55.22 29.81 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.812 -0.708 . . . . 0.88 112.277 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -171.93 135.37 0.82 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.006 0.432 . . . . 1.8600000000000001 110.553 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.583 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 65.3 m-85 -63.67 131.43 47.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.879 -0.6 . . . . 0.64000000000000001 110.895 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.641 HG23 ' CE1' ' A' ' 818' ' ' TYR . 1.8 m -127.63 -179.07 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.234 -0.439 . . . . 0.96999999999999997 110.789 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 2.5 t -98.75 116.94 42.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.054 0.454 . . . . 0.56000000000000005 111.295 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.71 108.0 12.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.81000000000000005 110.689 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -56.8 -67.13 2.38 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.829 -0.7 . . . . 0.81000000000000005 112.692 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 830' ' ' SER . . . . . 0.428 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -173.86 -137.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.421 -0.214 . . . . 1.3100000000000001 110.421 -179.791 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.431 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 28.3 t70 -59.88 -16.19 27.26 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.745 0.307 . . . . 2.2000000000000002 110.751 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.41 -69.43 0.4 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 2.21 110.854 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.91 -12.46 25.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.72999999999999998 110.519 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.608 ' CE2' HD22 ' A' ' 794' ' ' LEU . 3.4 t-105 -84.68 -39.67 18.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.277 -0.42 . . . . 0.26000000000000001 110.189 179.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.748 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -70.28 -33.48 71.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 1.98 109.836 179.011 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 66.6 t -74.84 -55.9 10.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.476 -0.784 . . . . 0.67000000000000004 110.203 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -56.12 -27.27 53.32 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.211 -0.449 . . . . 0.22 110.413 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.748 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 25.5 mtmt -66.44 -51.38 57.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.005 -0.543 . . . . 0.84999999999999998 110.359 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.69 -28.22 68.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 1.95 110.178 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 840' ' ' MET . . . . . 0.605 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 11.9 ttp -70.74 -36.71 73.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.715 -0.675 . . . . 0.29999999999999999 110.216 179.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.9 HD11 HD23 ' A' ' 849' ' ' LEU . 49.4 mt -67.04 -42.76 84.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.865 -0.607 . . . . 0.46999999999999997 110.914 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.431 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -72.01 -24.9 61.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.48999999999999999 111.235 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.04 6.11 1.01 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.309 -0.405 . . . . 1.6799999999999999 110.756 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 842' ' ' ALA . 65.1 m-80 -150.86 21.1 0.79 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.087 -0.506 . . . . 1.96 110.851 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.3 15.1 4.05 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.036 -0.529 . . . . 1.99 111.167 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.08 170.58 16.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.919 0.39 . . . . 2.2999999999999998 110.924 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -157.68 -22.28 0.09 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.92 -0.582 . . . . 1.98 111.272 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.591 ' HB3' HG22 ' A' ' 782' ' ' THR . 32.4 m-85 -86.4 122.49 30.43 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.841 0.353 . . . . 1.0900000000000001 111.174 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.9 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -105.86 121.45 44.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.014 -0.539 . . . . 0.73999999999999999 110.488 179.688 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.46 ' C ' HG13 ' A' ' 851' ' ' ILE . 46.3 m-80 -76.82 141.27 40.75 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.457 -0.338 . . . . 1.52 111.394 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.881 HD12 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -138.44 152.51 25.34 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 CA-C-N 116.194 -0.457 . . . . 1.04 111.421 179.807 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.412 ' HB3' ' HD1' ' A' ' 854' ' ' TYR . 1.3 mtp180 -113.46 176.67 4.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.439 -0.346 . . . . 5.0899999999999999 110.838 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -135.3 32.86 3.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.265 -0.425 . . . . 2.6000000000000001 110.953 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 854' ' ' TYR . . . . . 0.412 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 2.9 p90 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.253 -0.879 . . . . 3.3900000000000001 110.829 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.175 0 N-CA-C 112.524 -0.23 . . . . 9.0999999999999996 112.524 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 59.03 -177.73 0.08 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.941 0.4 . . . . 8.1199999999999992 111.279 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.03 -10.74 58.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.022 -0.536 . . . . 8.3399999999999999 110.905 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 115.11 -23.96 11.05 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.799 -0.715 . . . . 4.25 112.315 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.59 -44.28 82.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.781 0.324 . . . . 2.6099999999999999 110.738 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.565 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 1.5 mt -121.64 161.45 22.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 1.22 111.054 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 1.056 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -142.61 86.04 1.93 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.704 -0.48 . . . . 0.93999999999999995 109.704 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.571 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 2.1 m -97.76 118.76 35.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.82 -0.627 . . . . 0.67000000000000004 111.33 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.536 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -129.65 -168.3 1.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.731 -0.668 . . . . 1.5700000000000001 111.031 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 784' ' ' LEU . 0.0 OUTLIER -108.05 119.92 40.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.685 -0.688 . . . . 0.81000000000000005 109.472 178.799 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.569 HG13 ' CE3' ' A' ' 789' ' ' TRP . 89.1 t -117.69 145.19 23.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.227 -0.442 . . . . 1.1799999999999999 111.623 -178.648 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 4.7 tp10 -95.15 168.31 10.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.939 -0.573 . . . . 1.3999999999999999 110.742 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 787' ' ' LYS . . . . . 0.411 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -85.25 16.52 3.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 2.8500000000000001 110.993 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.09 -26.18 2.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.955 -0.566 . . . . 0.33000000000000002 111.117 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 789' ' ' TRP . . . . . 0.569 ' CE3' HG13 ' A' ' 785' ' ' VAL . 39.2 m0 -52.85 120.36 5.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.067 -0.515 . . . . 0.29999999999999999 112.103 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 790' ' ' ASN . . . . . 0.719 ' ND2' ' H ' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -94.05 160.4 14.73 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.54 -0.911 . . . . 1.8899999999999999 108.54 178.017 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.427 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 78.3 t80 -44.48 -34.86 2.22 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.542 0.21 . . . . 0.63 111.245 -178.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.719 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 33.8 t70 -68.62 -51.28 44.01 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.855 -0.424 . . . . 2.0499999999999998 109.855 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.23 -31.73 71.52 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.176 -0.466 . . . . 1.0700000000000001 110.32 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.569 HD22 ' CE2' ' A' ' 834' ' ' TRP . 29.8 tp -65.15 -52.98 51.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.648 -0.705 . . . . 0.93000000000000005 110.198 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.693 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 31.0 mm -54.36 -28.85 19.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.535 -0.757 . . . . 0.32000000000000001 111.212 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.609 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 6.1 mtp -67.35 -50.36 60.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.688 0.28 . . . . 1.53 110.443 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -55.06 -54.34 44.29 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.067 0.46 . . . . 0.38 110.144 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 65.4 mt -56.73 -51.01 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-N 115.765 -0.652 . . . . 0.5 110.394 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.693 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -56.48 -26.66 54.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.536 -0.756 . . . . 0.81000000000000005 111.319 -179.764 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 800' ' ' SER . . . . . 0.571 ' HA ' ' HB2' ' A' ' 804' ' ' ASN . 0.5 OUTLIER -79.75 -24.64 41.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.372 -0.376 . . . . 0.97999999999999998 111.194 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 801' ' ' LYS . . . . . 0.452 ' HB3' ' CE2' ' A' ' 781' ' ' PHE . 1.2 mptt -100.02 -6.78 25.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 2.25 111.334 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.592 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.4 pp -109.05 -32.45 2.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.771 0.32 . . . . 0.75 111.412 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 803' ' ' SER . . . . . 0.563 ' HB2' HD12 ' A' ' 802' ' ' ILE . 0.8 OUTLIER -152.78 79.5 1.21 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.383 -0.371 . . . . 1.53 111.088 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 804' ' ' ASN . . . . . 0.571 ' HB2' ' HA ' ' A' ' 800' ' ' SER . 0.6 OUTLIER -169.83 92.93 0.24 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.195 -0.457 . . . . 2.8300000000000001 111.037 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -157.83 -69.53 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.167 -0.47 . . . . 4.2000000000000002 110.983 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -114.65 131.32 56.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 7.6900000000000004 110.677 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 8.6 m120 58.44 -169.17 0.13 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.148 -0.478 . . . . 6.2199999999999998 110.988 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -73.22 179.8 3.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 6.8300000000000001 110.936 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -78.66 141.1 38.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.046 -0.524 . . . . 6.4100000000000001 110.916 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 2.7 mt -88.68 -61.64 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 4.7800000000000002 111.021 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 1.8 p -159.79 81.38 2.44 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 1.8 110.838 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -67.99 -162.34 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.541 2.16 . . . . 0.94999999999999996 112.215 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.452 HD12 HG22 ' A' ' 816' ' ' ILE . 9.4 pt -140.18 162.68 24.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.344 -0.389 . . . . 1.9399999999999999 111.155 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 5.8 p -129.09 -43.36 1.33 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.182 -0.463 . . . . 1.1599999999999999 111.156 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.94 114.99 22.08 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.258 -0.428 . . . . 2.6899999999999999 110.925 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 816' ' ' ILE . . . . . 0.579 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -135.75 176.18 8.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.267 -0.424 . . . . 0.83999999999999997 111.443 -179.847 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.525 ' HE2' HG22 ' A' ' 827' ' ' VAL . 12.3 mmtt -128.16 136.39 51.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.959 -0.564 . . . . 0.84999999999999998 110.403 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.616 ' CE1' HG23 ' A' ' 826' ' ' VAL . 3.7 p90 -116.35 177.99 4.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.92 0.391 . . . . 0.70999999999999996 111.421 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 819' ' ' GLN . . . . . 0.481 HE21 ' HA2' ' A' ' 823' ' ' GLY . 11.2 tp60 -100.1 111.3 23.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.001 -0.545 . . . . 1.9099999999999999 110.741 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.443 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 6.5 t70 -79.37 175.17 10.84 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.681 -0.691 . . . . 1.8 110.953 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.37 40.19 0.56 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.252 -0.431 . . . . 1.6200000000000001 111.09 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -140.28 15.7 2.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.342 -0.39 . . . . 1.6499999999999999 110.781 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 823' ' ' GLY . . . . . 0.481 ' HA2' HE21 ' A' ' 819' ' ' GLN . . . 58.3 54.13 40.15 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.81 -0.71 . . . . 0.88 112.23 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -172.75 133.51 0.58 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.925 0.393 . . . . 1.8600000000000001 110.658 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.534 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 67.0 m-85 -66.37 142.77 57.5 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.013 -0.54 . . . . 0.64000000000000001 110.704 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.616 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.3 OUTLIER -133.42 172.34 16.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 0.96999999999999997 110.714 179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 827' ' ' VAL . . . . . 0.525 HG22 ' HE2' ' A' ' 817' ' ' LYS . 1.8 t -98.78 113.07 32.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 0.56000000000000005 111.153 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.68 116.93 20.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.747 -0.661 . . . . 0.81000000000000005 110.896 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -65.72 -64.25 3.55 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.866 -0.683 . . . . 0.81000000000000005 112.615 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.36 -142.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.533 0.206 . . . . 1.3100000000000001 110.629 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.552 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 11.1 t70 -57.08 -15.1 4.6 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.724 0.297 . . . . 2.2000000000000002 111.168 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.468 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.0 OUTLIER -73.44 -73.62 0.21 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.438 -0.347 . . . . 2.21 111.021 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -12.49 10.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.396 -0.366 . . . . 0.72999999999999998 110.646 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.569 ' CE2' HD22 ' A' ' 794' ' ' LEU . 3.7 t-105 -85.36 -39.85 17.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.385 -0.371 . . . . 0.26000000000000001 110.145 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.736 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -69.43 -35.42 75.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.133 0.492 . . . . 1.98 109.879 178.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 832' ' ' GLU . 25.2 t -73.46 -55.19 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.625 -0.716 . . . . 0.67000000000000004 110.071 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.8 -27.64 52.2 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.058 -0.519 . . . . 0.22 110.374 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.736 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.3 mtmt -66.92 -47.92 70.26 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.972 -0.558 . . . . 0.84999999999999998 110.22 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -62.64 -32.64 73.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.042 -0.526 . . . . 1.95 109.946 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -64.63 -31.32 72.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.732 -0.667 . . . . 0.29999999999999999 110.119 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.89 HD11 HD23 ' A' ' 849' ' ' LEU . 1.5 mt -72.02 -42.69 66.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.788 -0.642 . . . . 0.46999999999999997 110.814 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.422 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -69.25 -20.52 63.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.463 . . . . 0.48999999999999999 111.197 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -68.07 3.61 1.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.489 . . . . 1.6799999999999999 110.577 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.12 20.06 0.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 1.96 110.901 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 58.62 19.08 6.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 1.99 111.006 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 846' ' ' GLU . . . . . 0.728 ' HB3' HD23 ' A' ' 841' ' ' LEU . 2.3 mt-10 -71.59 143.03 49.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 2.2999999999999998 110.816 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 847' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' A' ' 784' ' ' LEU . 27.4 mttt -136.09 14.59 3.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 1.98 110.751 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.536 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 19.6 m-85 -119.49 128.62 54.14 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.139 -0.482 . . . . 1.0900000000000001 111.251 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.89 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -115.46 129.06 56.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.005 -0.543 . . . . 0.73999999999999999 110.724 179.821 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.447 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 3.2 m120 -94.81 142.32 27.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.089 -0.505 . . . . 1.52 111.183 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 1.056 HD12 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -134.88 172.0 16.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.52 -0.309 . . . . 1.04 111.235 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.598 ' H ' HG22 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -126.46 -32.81 2.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.703 0.287 . . . . 5.0899999999999999 111.184 179.989 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 55.26 34.04 21.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.277 -0.42 . . . . 2.6000000000000001 111.053 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 1.1 p90 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.26 -0.876 . . . . 3.3900000000000001 110.984 -179.933 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 N-CA-C 112.48 -0.248 . . . . 9.0999999999999996 112.48 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 55.77 68.55 0.85 Allowed 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.775 0.321 . . . . 8.1199999999999992 111.035 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.6 102.8 9.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 8.3399999999999999 110.822 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 104.08 167.72 25.0 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.87 -0.681 . . . . 4.25 112.447 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 779' ' ' SER . . . . . 0.438 ' O ' HD22 ' A' ' 853' ' ' LEU . 0.4 OUTLIER -111.64 -59.76 1.94 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.74 0.305 . . . . 2.6099999999999999 111.088 -179.923 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.497 ' HA ' HD13 ' A' ' 853' ' ' LEU . 0.0 OUTLIER -128.16 -168.16 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.426 . . . . 1.22 111.097 -179.773 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.452 ' CB ' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -139.83 82.91 1.9 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.043 0.449 . . . . 0.93999999999999995 109.805 179.665 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.86 121.65 40.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.867 -0.606 . . . . 0.67000000000000004 111.458 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -112.58 -163.67 0.87 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.651 -0.704 . . . . 1.5700000000000001 110.629 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.414 HD12 ' HG3' ' A' ' 847' ' ' LYS . 0.3 OUTLIER -124.97 101.89 7.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.161 -0.472 . . . . 0.81000000000000005 110.341 179.503 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 31.4 m -93.36 165.13 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.985 -0.552 . . . . 1.1799999999999999 111.341 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.45 ' HG3' ' HE3' ' A' ' 787' ' ' LYS . 0.9 OUTLIER -116.99 175.57 5.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 1.3999999999999999 111.028 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 787' ' ' LYS . . . . . 0.45 ' HE3' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -89.17 54.89 3.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.181 0.515 . . . . 2.8500000000000001 110.735 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -168.31 -26.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.649 -0.705 . . . . 0.33000000000000002 110.587 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 27.3 m0 -52.08 126.11 17.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.693 -0.685 . . . . 0.29999999999999999 111.923 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.25 165.86 12.18 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.944 -0.761 . . . . 1.8899999999999999 108.944 178.314 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.401 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 92.0 t80 -51.42 -24.9 5.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.901 0.381 . . . . 0.63 110.297 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.64 ' O ' ' HG3' ' A' ' 796' ' ' MET . 1.5 m-20 -70.5 -62.89 1.22 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.017 -0.538 . . . . 2.0499999999999998 109.74 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.34 -29.26 33.17 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.112 0.482 . . . . 1.0700000000000001 110.336 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.576 HD22 ' CE2' ' A' ' 834' ' ' TRP . 26.5 tp -67.96 -53.61 24.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.784 -0.644 . . . . 0.93000000000000005 110.235 179.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.642 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 21.9 mm -60.09 -30.9 46.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.599 -0.728 . . . . 0.32000000000000001 111.211 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.64 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 21.3 mtp -69.13 -51.79 34.82 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.339 -0.245 . . . . 1.53 110.339 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.32 -52.01 62.88 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.014 0.435 . . . . 0.38 110.067 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.501 ' O ' HG23 ' A' ' 802' ' ' ILE . 71.5 mt -58.53 -52.48 59.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.636 -0.711 . . . . 0.5 110.423 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.651 ' HA ' HG12 ' A' ' 802' ' ' ILE . 7.0 t-20 -56.64 -21.59 28.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.614 -0.721 . . . . 0.81000000000000005 111.215 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 22.3 t -79.29 -31.42 43.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.97999999999999998 110.618 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -94.91 -8.63 36.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.96 -0.564 . . . . 2.25 111.245 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.651 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.3 pt -111.03 -23.94 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.476 -0.329 . . . . 0.75 111.36 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 803' ' ' SER . . . . . 0.476 ' N ' HG13 ' A' ' 802' ' ' ILE . 3.8 t -148.33 58.25 1.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 1.53 110.928 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -62.18 -49.79 74.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.151 -0.477 . . . . 2.8300000000000001 110.763 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.04 125.14 26.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 4.2000000000000002 111.139 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -91.79 -13.94 30.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 7.6900000000000004 110.9 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -99.1 177.2 5.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.124 -0.489 . . . . 6.2199999999999998 111.066 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 59.75 -92.51 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.925 -0.579 . . . . 6.8300000000000001 111.273 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -106.49 147.68 29.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.866 0.365 . . . . 6.4100000000000001 111.006 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -149.63 120.45 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.047 -0.524 . . . . 4.7800000000000002 111.073 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -159.7 79.02 2.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 1.8 110.854 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -77.26 -174.77 2.33 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.661 2.24 . . . . 0.94999999999999996 112.427 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.512 HG12 HD13 ' A' ' 802' ' ' ILE . 35.0 pt -135.77 174.34 12.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.022 -0.535 . . . . 1.9399999999999999 111.046 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 814' ' ' THR . . . . . 0.566 HG23 ' H ' ' A' ' 815' ' ' LYS . 0.0 OUTLIER -146.4 -60.75 0.31 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.238 -0.437 . . . . 1.1599999999999999 111.057 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 815' ' ' LYS . . . . . 0.566 ' H ' HG23 ' A' ' 814' ' ' THR . 1.5 tttp -92.44 126.81 37.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.293 -0.412 . . . . 2.6899999999999999 110.464 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -154.09 179.17 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.83999999999999997 111.564 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.75 ' H ' ' HB2' ' A' ' 852' ' ' ARG . 5.9 mttt -109.42 -178.35 3.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.84999999999999998 110.215 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.468 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 15.3 p90 -156.38 164.11 38.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.716 0.293 . . . . 0.70999999999999996 111.048 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 819' ' ' GLN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.7 OUTLIER -83.53 103.16 12.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.114 0.483 . . . . 1.9099999999999999 110.605 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -79.6 176.31 9.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.638 -0.71 . . . . 1.8 110.982 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 821' ' ' GLU . . . . . 0.475 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.2 OUTLIER -82.93 27.53 0.54 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 1.6200000000000001 110.954 179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.39 -0.52 14.47 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.239 -0.437 . . . . 1.6499999999999999 110.775 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 84.12 16.69 66.63 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.767 -0.73 . . . . 0.88 112.436 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -143.72 -145.41 0.17 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.743 0.306 . . . . 1.8600000000000001 110.561 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.468 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 97.4 m-85 -129.95 145.95 51.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.965 0.412 . . . . 0.64000000000000001 111.602 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.473 ' CG1' ' N ' ' A' ' 827' ' ' VAL . 10.0 t -122.55 163.99 20.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.645 -0.707 . . . . 0.96999999999999997 109.722 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 827' ' ' VAL . . . . . 0.473 ' N ' ' CG1' ' A' ' 826' ' ' VAL . 0.2 OUTLIER -97.65 107.52 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.065 0.459 . . . . 0.56000000000000005 111.296 -179.453 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.404 ' HG ' ' HB3' ' A' ' 833' ' ' ASP . 5.6 tt -79.6 136.8 36.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.652 -0.704 . . . . 0.81000000000000005 110.723 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -90.88 -59.39 1.41 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.654 -0.784 . . . . 0.81000000000000005 112.495 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -170.5 -141.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.358 -0.238 . . . . 1.3100000000000001 110.358 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -55.96 -23.52 32.69 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.666 0.27 . . . . 2.2000000000000002 110.896 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.585 ' O ' HG23 ' A' ' 836' ' ' VAL . 5.8 tt0 -64.88 -73.74 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.294 -0.412 . . . . 2.21 110.806 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 833' ' ' ASP . . . . . 0.404 ' HB3' ' HG ' ' A' ' 828' ' ' LEU . 0.4 OUTLIER -60.2 -12.59 9.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.301 -0.409 . . . . 0.72999999999999998 110.636 179.63 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.576 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.5 t-105 -81.37 -39.65 24.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.983 0.42 . . . . 0.26000000000000001 109.961 179.013 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -73.55 -28.87 62.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.999 -0.546 . . . . 1.98 109.68 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 832' ' ' GLU . 24.4 t -75.48 -53.99 14.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.585 -0.734 . . . . 0.67000000000000004 109.706 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.81 -29.63 65.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.661 -0.7 . . . . 0.22 110.457 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 838' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -67.46 -45.43 75.99 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.051 -0.522 . . . . 0.84999999999999998 110.518 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -61.76 -25.23 67.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.001 -0.545 . . . . 1.95 110.326 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 840' ' ' MET . . . . . 0.475 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 18.1 ttp -75.67 -38.44 58.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.68 -0.691 . . . . 0.29999999999999999 110.418 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.686 HD11 HD23 ' A' ' 849' ' ' LEU . 12.1 mt -62.76 -53.2 57.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.044 -0.526 . . . . 0.46999999999999997 110.806 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.424 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -62.53 -22.51 66.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.48999999999999999 111.039 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -67.7 3.37 1.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.077 -0.51 . . . . 1.6799999999999999 110.661 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.454 ' HB2' ' OE2' ' A' ' 846' ' ' GLU . 0.0 OUTLIER -154.98 22.57 0.44 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.465 . . . . 1.96 110.935 -180.0 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.7 m120 58.09 19.67 6.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.1 -0.5 . . . . 1.99 111.208 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 846' ' ' GLU . . . . . 0.454 ' OE2' ' HB2' ' A' ' 844' ' ' ASN . 0.1 OUTLIER -82.0 148.48 28.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.296 -0.411 . . . . 2.2999999999999998 110.635 179.803 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 847' ' ' LYS . . . . . 0.414 ' HG3' HD12 ' A' ' 784' ' ' LEU . 0.2 OUTLIER -141.68 11.04 2.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 1.98 110.97 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.455 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 64.9 m-85 -107.18 126.3 52.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.118 -0.492 . . . . 1.0900000000000001 110.733 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.686 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -123.68 126.56 46.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.232 -0.44 . . . . 0.73999999999999999 111.09 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 21.2 m-20 -88.12 -176.3 5.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.051 -0.522 . . . . 1.52 110.732 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.452 HG13 ' CB ' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -136.17 -176.15 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.811 0.339 . . . . 1.04 111.599 -179.953 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.75 ' HB2' ' H ' ' A' ' 817' ' ' LYS . 7.1 ttp180 -53.51 -78.8 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 5.0899999999999999 110.846 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 853' ' ' LEU . . . . . 0.497 HD13 ' HA ' ' A' ' 780' ' ' ILE . 0.2 OUTLIER 43.15 51.35 5.61 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.407 -0.36 . . . . 2.6000000000000001 111.438 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 854' ' ' TYR . . . . . 0.505 ' HD1' ' HG2' ' A' ' 852' ' ' ARG . 4.7 m-85 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.222 -0.894 . . . . 3.3900000000000001 110.865 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.324 0 N-CA-C 112.409 -0.276 . . . . 9.0999999999999996 112.409 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 55.63 49.56 16.22 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.913 0.387 . . . . 8.1199999999999992 111.131 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 14.5 mtp -76.8 -41.34 44.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 8.3399999999999999 110.823 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 153.12 136.73 2.39 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 4.25 112.521 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.55 20.31 16.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.793 0.33 . . . . 2.6099999999999999 110.779 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.528 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER -121.27 173.68 6.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 1.22 111.151 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.506 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.13 92.32 1.42 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.128 0.49 . . . . 0.93999999999999995 110.025 179.617 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.4 96.3 8.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.818 -0.628 . . . . 0.67000000000000004 110.729 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.532 HD11 ' HG3' ' A' ' 801' ' ' LYS . 0.3 OUTLIER -99.38 132.14 44.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.674 -0.694 . . . . 1.5700000000000001 111.128 -179.365 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.551 HD12 ' HE1' ' A' ' 848' ' ' PHE . 8.5 tt -65.87 107.01 1.69 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.092 -0.504 . . . . 0.81000000000000005 110.392 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.426 HG11 ' CH2' ' A' ' 834' ' ' TRP . 28.3 m -102.01 173.92 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.521 . . . . 1.1799999999999999 111.357 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.435 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 0.7 OUTLIER -119.4 170.33 9.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 1.3999999999999999 110.833 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 787' ' ' LYS . . . . . 0.435 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -83.46 14.86 3.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 2.8500000000000001 111.026 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 788' ' ' VAL . . . . . 0.434 HG12 ' HG2' ' A' ' 786' ' ' GLU . 1.6 p -127.35 -27.44 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.922 -0.581 . . . . 0.33000000000000002 110.909 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -47.92 125.11 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.922 -0.581 . . . . 0.29999999999999999 112.007 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.74 165.93 12.46 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.134 -0.691 . . . . 1.8899999999999999 109.134 178.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -50.98 -26.42 5.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.023 0.439 . . . . 0.63 110.213 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.643 ' O ' ' HG3' ' A' ' 796' ' ' MET . 14.0 t70 -71.89 -61.41 1.8 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.863 -0.608 . . . . 2.0499999999999998 109.577 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -53.79 -24.12 14.27 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.07 -0.514 . . . . 1.0700000000000001 110.128 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.631 HD22 ' CE2' ' A' ' 834' ' ' TRP . 32.5 tp -73.56 -57.34 4.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 0.93000000000000005 110.497 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.696 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.2 mm -58.0 -33.7 46.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.689 -0.687 . . . . 0.32000000000000001 111.901 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.643 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 3.3 mtp -72.32 -44.42 62.7 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.107 -0.237 . . . . 1.53 111.001 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -61.78 -47.29 85.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.167 0.508 . . . . 0.38 109.738 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.453 ' O ' HG23 ' A' ' 802' ' ' ILE . 17.5 mt -63.39 -49.64 81.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.478 -0.783 . . . . 0.5 110.126 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.696 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.6 OUTLIER -57.77 -23.76 53.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.838 -0.619 . . . . 0.81000000000000005 110.909 179.568 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 800' ' ' SER . . . . . 0.473 ' O ' ' HB2' ' A' ' 804' ' ' ASN . 0.7 OUTLIER -80.19 -27.74 38.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.97999999999999998 110.6 179.769 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 801' ' ' LYS . . . . . 0.532 ' HG3' HD11 ' A' ' 783' ' ' LEU . 8.1 mmpt? -97.82 -4.18 37.31 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.052 -0.522 . . . . 2.25 111.394 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.2 pp -113.8 -31.16 2.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.7 0.286 . . . . 0.75 111.422 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 803' ' ' SER . . . . . 0.402 ' N ' HG13 ' A' ' 802' ' ' ILE . 1.2 m -154.8 90.12 1.28 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.926 0.393 . . . . 1.53 111.139 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 804' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 800' ' ' SER . 9.5 t-20 -130.71 -8.94 4.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.059 -0.519 . . . . 2.8300000000000001 110.793 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 805' ' ' THR . . . . . 0.53 HG22 ' H ' ' A' ' 807' ' ' ASN . 1.9 m -66.46 156.15 35.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.104 -0.498 . . . . 4.2000000000000002 111.134 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -103.88 -20.46 13.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 7.6900000000000004 110.843 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 807' ' ' ASN . . . . . 0.53 ' H ' HG22 ' A' ' 805' ' ' THR . 0.6 OUTLIER -79.48 137.96 37.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.118 -0.492 . . . . 6.2199999999999998 111.045 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 56.9 -166.12 0.14 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.034 -0.53 . . . . 6.8300000000000001 111.143 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -76.61 -174.96 3.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.09 -0.505 . . . . 6.4100000000000001 110.837 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 810' ' ' ILE . . . . . 0.479 HG13 ' H ' ' A' ' 811' ' ' SER . 2.8 pt -142.38 -50.39 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 4.7800000000000002 111.171 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 811' ' ' SER . . . . . 0.479 ' H ' HG13 ' A' ' 810' ' ' ILE . 19.6 m 55.33 76.98 0.45 Allowed Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.198 -0.456 . . . . 1.8 110.995 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 812' ' ' PRO . . . . . 0.551 ' HB2' HD21 ' A' ' 799' ' ' ASN . 53.7 Cg_endo -69.91 -171.76 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.529 2.153 . . . . 0.94999999999999996 112.53 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.496 HG12 HD13 ' A' ' 802' ' ' ILE . 3.4 pt -145.0 163.57 13.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.162 -0.472 . . . . 1.9399999999999999 111.1 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 1.2 p -133.16 -63.01 0.78 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.313 -0.403 . . . . 1.1599999999999999 111.275 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -82.14 126.11 31.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 2.6899999999999999 110.96 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -153.53 174.88 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.83999999999999997 111.212 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.453 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 15.0 mttt -115.37 152.99 31.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.84999999999999998 110.81 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.43 ' CE2' ' HB2' ' A' ' 828' ' ' LEU . 6.9 p90 -129.35 179.26 5.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.379 -0.373 . . . . 0.70999999999999996 110.898 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 819' ' ' GLN . . . . . 0.529 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -92.86 115.7 28.36 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.461 0.648 . . . . 1.9099999999999999 110.748 179.906 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -93.18 177.45 6.05 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 114.859 -1.064 . . . . 1.8 111.132 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -78.92 13.31 1.78 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.103 -0.499 . . . . 1.6200000000000001 111.113 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.48 4.7 46.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.427 . . . . 1.6499999999999999 110.628 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 75.72 10.48 84.85 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.914 -0.66 . . . . 0.88 112.475 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.64 -149.85 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.752 0.31 . . . . 1.8600000000000001 110.472 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.41 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 48.5 m-85 -128.41 139.75 52.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.384 -0.371 . . . . 0.64000000000000001 110.913 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.453 ' C ' ' HD3' ' A' ' 817' ' ' LYS . 8.9 m -123.39 173.15 9.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.419 -0.355 . . . . 0.96999999999999997 110.745 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -98.75 123.53 51.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.036 0.446 . . . . 0.56000000000000005 111.492 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 834' ' ' TRP . 5.3 tp -81.76 109.73 16.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.81000000000000005 110.723 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -64.5 -60.72 6.7 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.811 -0.709 . . . . 0.81000000000000005 112.644 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 830' ' ' SER . . . . . 0.446 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -171.23 -142.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.476 -0.194 . . . . 1.3100000000000001 110.476 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.446 ' H ' ' HB3' ' A' ' 830' ' ' SER . 6.0 p-10 -61.67 -15.4 39.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.896 0.379 . . . . 2.2000000000000002 110.91 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.472 ' O ' HG23 ' A' ' 836' ' ' VAL . 44.4 mt-10 -73.72 -68.8 0.48 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.229 -0.441 . . . . 2.21 110.784 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.18 -13.52 18.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.308 -0.405 . . . . 0.72999999999999998 110.546 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.631 ' CE2' HD22 ' A' ' 794' ' ' LEU . 2.2 t-105 -81.72 -47.48 12.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.198 -0.455 . . . . 0.26000000000000001 110.037 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.31 -32.92 74.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.982 -0.554 . . . . 1.98 109.877 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 832' ' ' GLU . 58.9 t -74.04 -53.93 16.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.474 -0.785 . . . . 0.67000000000000004 109.97 179.232 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -53.39 -28.43 29.36 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.03 -0.532 . . . . 0.22 110.185 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.506 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 2.0 mtpp -67.73 -47.9 68.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.765 -0.652 . . . . 0.84999999999999998 110.366 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -60.17 -28.44 67.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.073 -0.512 . . . . 1.95 110.205 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 19.4 ttp -69.92 -39.44 76.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.825 -0.625 . . . . 0.29999999999999999 110.278 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.403 HD22 ' HB3' ' A' ' 846' ' ' GLU . 26.6 mt -66.59 -48.87 68.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.923 -0.58 . . . . 0.46999999999999997 110.705 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 842' ' ' ALA . . . . . . . . . . . . . . . -63.02 -23.47 67.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 0.48999999999999999 110.957 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.36 -0.81 2.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.039 -0.528 . . . . 1.6799999999999999 110.452 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 844' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.41 20.36 1.71 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.8 -0.637 . . . . 1.96 110.637 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.66 25.06 14.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.976 -0.556 . . . . 1.99 111.238 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 846' ' ' GLU . . . . . 0.403 ' HB3' HD22 ' A' ' 841' ' ' LEU . 2.1 mm-40 -85.48 171.85 11.46 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.48 -0.327 . . . . 2.2999999999999998 110.727 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 847' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 784' ' ' LEU . 15.3 pttt -159.85 11.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.31 -0.405 . . . . 1.98 111.414 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.551 ' HE1' HD12 ' A' ' 784' ' ' LEU . 29.4 m-85 -120.83 124.39 44.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.893 0.377 . . . . 1.0900000000000001 111.068 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.53 ' HG ' ' HZ3' ' A' ' 834' ' ' TRP . 0.7 OUTLIER -101.82 116.24 32.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.06 -0.518 . . . . 0.73999999999999999 110.178 179.55 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.529 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 7.2 m120 -72.16 162.69 29.11 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.058 -0.519 . . . . 1.52 111.302 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.528 ' O ' ' HA ' ' A' ' 780' ' ' ILE . 3.5 mm -141.51 152.67 19.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.208 -0.451 . . . . 1.04 111.029 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.621 ' HB3' ' HD1' ' A' ' 854' ' ' TYR . 0.0 OUTLIER -104.84 -28.22 11.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.469 -0.332 . . . . 5.0899999999999999 110.501 179.646 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 853' ' ' LEU . . . . . 0.451 ' H ' HG22 ' A' ' 851' ' ' ILE . 1.0 OUTLIER 56.22 23.55 7.19 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.005 -0.543 . . . . 2.6000000000000001 111.014 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 854' ' ' TYR . . . . . 0.621 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.21 -0.9 . . . . 3.3900000000000001 110.961 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.133 0 N-CA-C 112.451 -0.26 . . . . 9.0999999999999996 112.451 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -136.92 131.31 32.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.885 0.374 . . . . 8.1199999999999992 111.141 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 15.1 mtt -80.83 141.58 34.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.162 -0.472 . . . . 8.3399999999999999 110.838 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -137.34 -3.54 2.13 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.852 -0.689 . . . . 4.25 112.385 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 47.9 t -103.3 104.85 15.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.744 0.307 . . . . 2.6099999999999999 110.977 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.856 ' HA ' ' HG ' ' A' ' 853' ' ' LEU . 0.2 OUTLIER -131.07 -157.71 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.276 -0.42 . . . . 1.22 111.029 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.752 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -144.37 87.15 1.86 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.089 0.471 . . . . 0.93999999999999995 110.078 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.455 HG23 ' OD1' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -98.19 91.69 5.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.655 -0.702 . . . . 0.67000000000000004 111.229 -179.336 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.17 144.61 26.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.804 -0.634 . . . . 1.5700000000000001 110.956 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.409 ' HB2' ' HE1' ' A' ' 848' ' ' PHE . 1.2 tt -85.01 114.45 22.18 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.252 -0.431 . . . . 0.81000000000000005 110.316 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.442 HG11 ' CH2' ' A' ' 834' ' ' TRP . 34.9 m -98.51 -173.69 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.92 -0.582 . . . . 1.1799999999999999 111.497 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.562 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 3.9 tp10 -133.86 167.92 19.69 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.952 -0.567 . . . . 1.3999999999999999 110.676 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 787' ' ' LYS . . . . . 0.562 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -82.8 49.52 1.51 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.253 -0.43 . . . . 2.8500000000000001 110.781 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -166.09 -25.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.138 -0.483 . . . . 0.33000000000000002 110.987 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -52.65 123.86 12.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.855 -0.612 . . . . 0.29999999999999999 111.922 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.23 168.76 11.11 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.804 -0.813 . . . . 1.8899999999999999 108.804 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.428 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 63.3 t80 -53.56 -26.11 20.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.139 0.495 . . . . 0.63 110.252 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.615 ' O ' ' HG3' ' A' ' 796' ' ' MET . 2.5 m-20 -70.18 -63.72 1.03 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.694 -0.685 . . . . 2.0499999999999998 109.766 178.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.97 -29.8 31.11 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.223 -0.444 . . . . 1.0700000000000001 110.323 179.311 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.591 HD22 ' CE2' ' A' ' 834' ' ' TRP . 30.2 tp -66.86 -54.32 23.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.824 -0.626 . . . . 0.93000000000000005 110.429 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.67 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.9 mm -59.52 -33.06 50.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.639 -0.709 . . . . 0.32000000000000001 111.621 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.615 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 4.7 mtt -68.28 -52.78 29.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.657 0.265 . . . . 1.53 110.499 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.42 -52.89 57.93 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.203 -0.453 . . . . 0.38 110.039 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.484 ' O ' HG12 ' A' ' 802' ' ' ILE . 93.4 mt -57.05 -52.39 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.757 -0.656 . . . . 0.5 110.583 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.683 ' HA ' HG12 ' A' ' 802' ' ' ILE . 1.1 t-20 -54.68 -29.82 53.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.502 -0.772 . . . . 0.81000000000000005 111.379 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 29.5 t -75.88 -26.25 56.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.468 -0.333 . . . . 0.97999999999999998 111.017 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -101.57 -0.43 34.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.273 -0.422 . . . . 2.25 111.566 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.683 HG12 ' HA ' ' A' ' 799' ' ' ASN . 14.0 pt -117.01 -26.38 2.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.681 0.276 . . . . 0.75 111.628 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 21.6 p -121.92 34.25 5.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.979 0.419 . . . . 1.53 111.124 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -68.0 176.55 2.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.042 -0.526 . . . . 2.8300000000000001 110.951 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.44 31.17 0.83 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.11 -0.495 . . . . 4.2000000000000002 111.164 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -127.23 -27.56 2.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 7.6900000000000004 110.905 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -86.64 179.2 6.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 6.2199999999999998 110.862 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -100.05 -24.35 14.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.081 -0.509 . . . . 6.8300000000000001 110.872 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -63.09 106.08 0.8 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.309 -0.405 . . . . 6.4100000000000001 110.872 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.88 -27.29 5.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 4.7800000000000002 111.201 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 1.3 t -90.54 123.63 64.77 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 1.8 110.851 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 812' ' ' PRO . . . . . 0.5 ' HB2' HD21 ' A' ' 799' ' ' ASN . 68.9 Cg_endo -74.05 -179.23 4.46 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.546 2.164 . . . . 0.94999999999999996 112.284 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.492 HG13 HD12 ' A' ' 802' ' ' ILE . 2.1 mt -128.52 151.48 35.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.095 -0.502 . . . . 1.9399999999999999 111.364 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.39 -71.44 0.74 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.021 -0.536 . . . . 1.1599999999999999 110.834 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -83.88 131.62 34.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 2.6899999999999999 110.592 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -151.61 -174.72 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.307 -0.406 . . . . 0.83999999999999997 111.448 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.59 ' H ' ' HG3' ' A' ' 852' ' ' ARG . 17.2 mttt -116.21 175.38 5.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.567 . . . . 0.84999999999999998 110.173 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.63 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 22.7 p90 -148.44 166.28 28.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.921 0.391 . . . . 0.70999999999999996 111.112 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 819' ' ' GLN . . . . . 0.513 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 1.9 tp60 -96.39 108.45 20.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 1.9099999999999999 110.577 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.426 ' HB3' ' CG2' ' A' ' 826' ' ' VAL . 0.1 OUTLIER -79.12 -178.2 6.03 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.756 -0.657 . . . . 1.8 111.064 -179.834 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 821' ' ' GLU . . . . . 0.514 ' HG2' ' HG3' ' A' ' 840' ' ' MET . 3.2 pt-20 -87.2 33.99 0.68 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.277 -0.42 . . . . 1.6200000000000001 111.59 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -139.17 14.93 2.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.36 -0.382 . . . . 1.6499999999999999 110.735 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 59.84 59.13 11.05 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.842 -0.694 . . . . 0.88 112.237 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -169.36 132.59 1.28 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.965 0.412 . . . . 1.8600000000000001 110.493 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.583 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 49.4 m-85 -73.9 126.51 30.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 0.64000000000000001 111.018 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.63 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 1.3 t -108.27 170.62 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.903 -0.59 . . . . 0.96999999999999997 111.076 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 827' ' ' VAL . . . . . 0.501 ' H ' HG12 ' A' ' 826' ' ' VAL . 1.4 t -99.65 107.0 19.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.33 -0.396 . . . . 0.56000000000000005 111.197 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.89 110.19 18.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.53 . . . . 0.81000000000000005 110.736 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -62.42 -65.11 3.36 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.858 -0.686 . . . . 0.81000000000000005 112.605 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 85.1 p -170.2 -131.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.495 -0.187 . . . . 1.3100000000000001 110.495 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -62.8 -11.57 18.73 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.786 0.327 . . . . 2.2000000000000002 110.906 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -79.07 -68.95 0.61 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.236 -0.438 . . . . 2.21 110.954 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.85 -11.99 21.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.297 -0.41 . . . . 0.72999999999999998 110.568 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.591 ' CE2' HD22 ' A' ' 794' ' ' LEU . 0.9 OUTLIER -81.31 -45.2 16.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.309 -0.405 . . . . 0.26000000000000001 110.019 179.267 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.69 -36.18 80.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.958 -0.564 . . . . 1.98 109.957 178.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 87.9 t -70.2 -53.88 21.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.51 -0.768 . . . . 0.67000000000000004 110.06 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.21 -25.06 58.45 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.086 -0.507 . . . . 0.22 109.981 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 1.4 mtpp -65.4 -49.34 69.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.799 -0.637 . . . . 0.84999999999999998 110.096 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.37 -27.07 67.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.866 -0.606 . . . . 1.95 110.449 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 840' ' ' MET . . . . . 0.514 ' HG3' ' HG2' ' A' ' 821' ' ' GLU . 10.8 ttp -74.34 -38.23 63.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.945 -0.57 . . . . 0.29999999999999999 110.515 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.616 HD11 HD23 ' A' ' 849' ' ' LEU . 14.3 mt -63.13 -42.24 99.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.085 -0.507 . . . . 0.46999999999999997 110.757 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -68.16 -23.86 64.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.506 . . . . 0.48999999999999999 111.324 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.41 4.21 1.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 1.6799999999999999 110.639 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.445 ' H ' ' C ' ' A' ' 842' ' ' ALA . 35.5 m-80 -151.88 14.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 1.96 110.867 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.9 m120 62.25 14.9 7.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.148 -0.478 . . . . 1.99 111.291 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.04 169.61 9.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.389 . . . . 2.2999999999999998 110.864 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 847' ' ' LYS . . . . . 0.402 ' O ' HG22 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -151.62 -30.67 0.17 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.337 -0.392 . . . . 1.98 111.036 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.409 ' HE1' ' HB2' ' A' ' 784' ' ' LEU . 26.0 m-85 -79.53 149.51 31.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.297 -0.411 . . . . 1.0900000000000001 110.667 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.616 HD23 HD11 ' A' ' 841' ' ' LEU . 0.2 OUTLIER -136.27 114.71 11.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.219 -0.446 . . . . 0.73999999999999999 111.161 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.513 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 24.8 m-20 -72.36 173.41 8.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.292 -0.413 . . . . 1.52 110.718 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.752 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -133.77 178.0 6.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.414 -0.357 . . . . 1.04 111.492 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.653 ' H ' HG22 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -40.21 -70.59 0.1 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.011 -0.541 . . . . 5.0899999999999999 111.654 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 853' ' ' LEU . . . . . 0.856 ' HG ' ' HA ' ' A' ' 780' ' ' ILE . 0.2 OUTLIER 59.11 22.05 10.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.886 -0.597 . . . . 2.6000000000000001 109.971 -178.894 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 854' ' ' TYR . . . . . 0.447 ' HB2' ' HD3' ' A' ' 852' ' ' ARG . 30.1 m-85 . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.194 -0.908 . . . . 3.3900000000000001 110.819 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 112.617 -0.193 . . . . 9.0999999999999996 112.617 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 57.67 83.7 0.11 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.873 0.368 . . . . 8.1199999999999992 111.078 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 1.8 ptp -140.22 -177.45 5.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.164 -0.471 . . . . 8.3399999999999999 110.939 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 169.98 -166.19 39.45 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.796 -0.716 . . . . 4.25 112.708 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 11.4 m -104.73 131.82 51.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.804 0.335 . . . . 2.6099999999999999 111.016 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER -120.78 172.31 8.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.463 . . . . 1.22 110.792 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.563 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -153.86 89.7 1.33 Allowed 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.919 0.39 . . . . 0.93999999999999995 110.399 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.521 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.1 OUTLIER -98.36 93.17 6.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.985 -0.552 . . . . 0.67000000000000004 111.111 -179.564 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.76 161.08 14.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.69 -0.686 . . . . 1.5700000000000001 110.886 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.464 HD12 ' HB2' ' A' ' 847' ' ' LYS . 0.3 OUTLIER -96.56 111.79 23.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.81000000000000005 110.269 179.448 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.496 HG11 ' CH2' ' A' ' 834' ' ' TRP . 30.0 m -97.52 -171.41 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.101 -0.499 . . . . 1.1799999999999999 111.433 -179.428 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.422 ' O ' ' HD2' ' A' ' 838' ' ' LYS . 0.8 OUTLIER -138.78 170.86 15.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.045 -0.525 . . . . 1.3999999999999999 110.838 -179.771 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -85.76 49.98 1.88 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.055 0.455 . . . . 2.8500000000000001 110.512 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.6 p -165.21 -27.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.947 -0.569 . . . . 0.33000000000000002 110.791 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 30.3 m0 -52.6 122.75 9.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.921 -0.582 . . . . 0.29999999999999999 111.85 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 790' ' ' ASN . . . . . 0.643 HD21 ' HB2' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -95.97 159.22 15.08 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.874 -0.787 . . . . 1.8899999999999999 108.874 178.372 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.481 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 86.4 t80 -44.52 -33.01 1.59 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.698 0.285 . . . . 0.63 111.31 -178.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.643 ' HB2' HD21 ' A' ' 790' ' ' ASN . 2.3 m-20 -69.24 -51.91 32.89 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.925 -0.398 . . . . 2.0499999999999998 109.925 178.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 793' ' ' ASP . . . . . 0.613 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.6 OUTLIER -61.11 -29.53 69.82 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 120.995 0.426 . . . . 1.0700000000000001 110.247 179.205 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.559 HD22 ' CE2' ' A' ' 834' ' ' TRP . 34.2 tp -67.17 -52.32 42.82 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.825 -0.625 . . . . 0.93000000000000005 110.384 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.669 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 32.8 mm -57.03 -29.09 30.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.549 -0.751 . . . . 0.32000000000000001 111.706 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.592 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 10.1 mtt -67.94 -53.43 26.35 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.668 0.271 . . . . 1.53 110.336 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.0 -54.35 36.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.144 -0.48 . . . . 0.38 110.117 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 68.5 mt -55.64 -51.1 62.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-N 115.765 -0.652 . . . . 0.5 110.356 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.669 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 3.5 t30 -56.06 -28.45 57.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.624 -0.716 . . . . 0.81000000000000005 111.338 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 43.0 t -77.24 -23.51 51.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.278 -0.419 . . . . 0.97999999999999998 110.875 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.07 0.24 27.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 2.25 111.414 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.582 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.7 pt -120.35 -22.21 3.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.571 -0.286 . . . . 0.75 111.393 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 8.7 t -136.79 40.41 2.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.389 -0.369 . . . . 1.53 110.999 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -165.59 26.33 0.05 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.276 -0.42 . . . . 2.8300000000000001 111.022 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.91 -64.35 1.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 4.2000000000000002 110.979 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.71 170.08 12.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.295 -0.411 . . . . 7.6900000000000004 110.835 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -125.1 77.01 1.59 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 6.2199999999999998 111.008 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.17 -67.59 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 6.8300000000000001 110.89 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -129.09 138.71 52.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 6.4100000000000001 110.847 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 1.1 pt -103.38 150.41 6.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.123 -0.489 . . . . 4.7800000000000002 111.137 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -153.12 88.36 3.81 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 1.8 110.996 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -76.23 137.53 19.18 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.463 2.109 . . . . 0.94999999999999996 112.257 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.429 HG13 ' CD1' ' A' ' 802' ' ' ILE . 2.3 mt -125.64 149.26 30.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.064 -0.516 . . . . 1.9399999999999999 111.337 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 2.9 p -122.89 -44.42 2.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.996 -0.547 . . . . 1.1599999999999999 110.836 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.08 130.47 41.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 2.6899999999999999 110.712 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 816' ' ' ILE . . . . . 0.658 HG22 ' HA ' ' A' ' 853' ' ' LEU . 1.0 OUTLIER -152.08 168.54 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.972 0.415 . . . . 0.83999999999999997 111.409 -179.708 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.471 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 16.7 mmtt -113.66 136.9 52.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.784 -0.644 . . . . 0.84999999999999998 110.385 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.592 ' CE1' HG23 ' A' ' 826' ' ' VAL . 4.2 p90 -114.85 173.32 6.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.811 0.338 . . . . 0.70999999999999996 111.274 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -100.38 108.29 20.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.081 -0.509 . . . . 1.9099999999999999 110.504 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.461 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 4.1 t70 -79.08 173.6 12.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.824 -0.626 . . . . 1.8 110.829 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.11 10.09 2.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.245 -0.434 . . . . 1.6200000000000001 111.043 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.86 10.38 41.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 1.6499999999999999 110.848 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 61.71 51.73 55.46 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.859 -0.686 . . . . 0.88 112.468 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.96 141.87 0.27 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.024 0.44 . . . . 1.8600000000000001 110.429 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.49 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 63.6 m-85 -66.15 142.85 57.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.836 -0.62 . . . . 0.64000000000000001 110.488 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.592 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -133.1 173.03 15.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.219 -0.446 . . . . 0.96999999999999997 110.486 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.57 113.71 34.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.931 0.396 . . . . 0.56000000000000005 111.42 -179.288 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.9 tt -80.25 115.7 19.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.776 -0.647 . . . . 0.81000000000000005 110.952 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -61.52 -69.25 1.35 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.852 -0.69 . . . . 0.81000000000000005 112.549 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 830' ' ' SER . . . . . 0.48 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 1.2 p -170.51 -140.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 110.442 -0.207 . . . . 1.3100000000000001 110.442 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.48 ' H ' ' HB2' ' A' ' 830' ' ' SER . 0.9 OUTLIER -55.61 -24.05 30.98 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.745 0.307 . . . . 2.2000000000000002 111.033 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -64.94 0.8 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.392 -0.367 . . . . 2.21 110.757 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.83 -13.92 28.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.72999999999999998 110.641 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.559 ' CE2' HD22 ' A' ' 794' ' ' LEU . 5.3 t-105 -86.58 -44.25 12.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.381 -0.372 . . . . 0.26000000000000001 110.192 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -64.84 -27.7 69.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.189 0.518 . . . . 1.98 109.835 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 88.4 t -82.54 -58.32 3.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.474 -0.785 . . . . 0.67000000000000004 110.108 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -52.94 -30.96 37.64 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.135 -0.484 . . . . 0.22 110.533 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' A' ' 786' ' ' GLU . 11.9 ttpt -69.66 -52.18 28.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.801 -0.636 . . . . 0.84999999999999998 109.979 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.32 -26.55 61.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.438 -0.801 . . . . 1.95 110.162 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 12.3 ttp -70.83 -40.87 72.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.772 -0.649 . . . . 0.29999999999999999 110.232 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.84 HD11 HD23 ' A' ' 849' ' ' LEU . 17.4 mt -62.27 -35.22 78.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.736 -0.665 . . . . 0.46999999999999997 110.814 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -73.82 -22.26 59.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.321 -0.399 . . . . 0.48999999999999999 111.178 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -69.77 6.27 1.22 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 1.6799999999999999 110.667 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.441 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.03 22.36 0.5 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.028 -0.533 . . . . 1.96 110.852 -179.902 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 58.05 16.12 3.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.102 -0.499 . . . . 1.99 111.181 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 846' ' ' GLU . . . . . 0.464 ' HB3' HD22 ' A' ' 841' ' ' LEU . 3.7 mt-10 -82.72 140.39 33.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 2.2999999999999998 110.807 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 847' ' ' LYS . . . . . 0.464 ' HB2' HD12 ' A' ' 784' ' ' LEU . 0.1 OUTLIER -135.74 30.6 3.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 1.98 110.759 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.521 ' HB3' HG22 ' A' ' 782' ' ' THR . 8.9 m-85 -125.88 126.0 43.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.117 -0.492 . . . . 1.0900000000000001 110.889 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.84 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -115.36 117.77 31.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 0.73999999999999999 110.502 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.444 ' C ' HG12 ' A' ' 851' ' ' ILE . 1.9 m-20 -84.21 152.91 23.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.261 -0.427 . . . . 1.52 111.481 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.563 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -134.95 165.88 29.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 116.088 -0.505 . . . . 1.04 111.19 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.468 ' H ' HG22 ' A' ' 851' ' ' ILE . 6.6 ttt85 -114.15 -31.07 6.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.318 -0.401 . . . . 5.0899999999999999 110.542 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 853' ' ' LEU . . . . . 0.658 ' HA ' HG22 ' A' ' 816' ' ' ILE . 1.8 mp 55.83 53.85 8.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.988 -0.551 . . . . 2.6000000000000001 111.293 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 1.2 p90 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.184 -0.912 . . . . 3.3900000000000001 110.906 179.858 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 N-CA-C 112.489 -0.244 . . . . 9.0999999999999996 112.489 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -163.34 -12.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.854 0.359 . . . . 8.1199999999999992 111.111 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 4.0 ptt? -104.66 24.84 11.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 8.3399999999999999 110.994 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -151.54 163.14 29.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.637 -0.792 . . . . 4.25 112.694 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 58.68 87.22 0.08 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.917 0.389 . . . . 2.6099999999999999 111.17 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.487 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.3 OUTLIER -126.8 -166.78 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.032 -0.531 . . . . 1.22 110.702 179.949 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.797 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.2 OUTLIER -158.23 93.03 1.2 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.982 0.42 . . . . 0.93999999999999995 110.138 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.97 92.21 5.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.024 -0.535 . . . . 0.67000000000000004 110.989 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.08 139.89 30.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.741 -0.663 . . . . 1.5700000000000001 110.962 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.614 HD12 ' HE1' ' A' ' 848' ' ' PHE . 6.4 tt -72.32 104.21 3.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.935 0.398 . . . . 0.81000000000000005 110.59 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.611 HG11 ' CZ2' ' A' ' 834' ' ' TRP . 67.8 t -94.68 147.3 5.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.018 -0.537 . . . . 1.1799999999999999 111.372 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -96.06 170.82 9.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 1.3999999999999999 110.548 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.44 54.18 3.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.359 -0.382 . . . . 2.8500000000000001 110.762 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.5 p -166.75 -24.07 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.108 -0.496 . . . . 0.33000000000000002 111.036 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 789' ' ' TRP . . . . . 0.474 ' CE3' HG13 ' A' ' 785' ' ' VAL . 38.2 m0 -53.51 122.28 9.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.081 -0.509 . . . . 0.29999999999999999 112.034 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 790' ' ' ASN . . . . . 0.767 HD21 ' HB2' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -95.33 158.12 15.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.613 -0.884 . . . . 1.8899999999999999 108.613 178.294 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.496 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 92.7 t80 -42.54 -33.81 0.75 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.748 0.308 . . . . 0.63 111.336 -178.7 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.767 ' HB2' HD21 ' A' ' 790' ' ' ASN . 1.5 m-20 -69.02 -55.01 12.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.791 -0.448 . . . . 2.0499999999999998 109.791 178.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 793' ' ' ASP . . . . . 0.608 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.7 OUTLIER -59.56 -29.71 68.12 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 120.974 0.416 . . . . 1.0700000000000001 110.498 179.302 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.578 HD22 ' CE2' ' A' ' 834' ' ' TRP . 32.4 tp -66.27 -52.95 42.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.897 -0.592 . . . . 0.93000000000000005 110.217 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.692 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.3 mm -57.26 -31.84 39.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.47 -0.786 . . . . 0.32000000000000001 111.527 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.645 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.2 mtt -68.17 -53.85 22.12 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.983 -0.287 . . . . 1.53 110.539 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -52.27 -53.68 40.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.027 0.442 . . . . 0.38 110.085 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.491 ' O ' HG12 ' A' ' 802' ' ' ILE . 94.2 mt -56.81 -53.2 45.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.668 -0.696 . . . . 0.5 110.509 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.692 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -53.52 -28.0 28.8 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.648 -0.705 . . . . 0.81000000000000005 111.285 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.07 -30.91 61.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.466 -0.334 . . . . 0.97999999999999998 111.065 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.39 0.74 45.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.326 -0.397 . . . . 2.25 111.512 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 4.1 pt -122.4 -14.65 6.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.67 0.272 . . . . 0.75 111.611 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 2.2 t -142.03 -42.05 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.773 0.321 . . . . 1.53 111.198 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 20.8 t30 57.5 -173.78 0.08 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.152 -0.476 . . . . 2.8300000000000001 111.013 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 1.5 m -121.07 -10.23 9.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 4.2000000000000002 110.941 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -128.93 149.87 50.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.077 -0.51 . . . . 7.6900000000000004 110.939 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 6.4 m120 63.99 -82.45 0.03 OUTLIER 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.972 -0.558 . . . . 6.2199999999999998 111.224 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -71.64 145.97 48.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.952 0.406 . . . . 6.8300000000000001 111.268 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -173.6 92.06 0.09 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.961 -0.563 . . . . 6.4100000000000001 110.566 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 13.0 mm -111.88 -76.85 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.266 -0.425 . . . . 4.7800000000000002 111.294 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 811' ' ' SER . . . . . 0.428 ' HA ' ' HD3' ' A' ' 812' ' ' PRO . 2.0 p -164.76 122.15 1.12 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.298 -0.41 . . . . 1.8 110.911 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 812' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 811' ' ' SER . 19.0 Cg_exo -65.82 147.03 84.92 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.569 2.18 . . . . 0.94999999999999996 112.08 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 14.5 mm -110.56 152.35 12.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.455 . . . . 1.9399999999999999 111.002 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.58 -56.18 1.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 1.1599999999999999 111.162 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 815' ' ' LYS . . . . . 0.402 ' HE2' HG12 ' A' ' 827' ' ' VAL . 1.3 tttt -92.59 118.47 31.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.247 -0.433 . . . . 2.6899999999999999 110.872 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 816' ' ' ILE . . . . . 0.574 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -134.61 169.22 21.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.093 -0.503 . . . . 0.83999999999999997 111.299 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.56 ' H ' ' HB2' ' A' ' 852' ' ' ARG . 12.4 mmtt -107.64 172.26 6.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.969 -0.56 . . . . 0.84999999999999998 110.553 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.599 ' CE1' HG23 ' A' ' 826' ' ' VAL . 11.0 p90 -156.19 153.03 28.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.02 0.438 . . . . 0.70999999999999996 111.524 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -80.04 106.65 12.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.763 -0.653 . . . . 1.9099999999999999 110.694 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.412 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 6.9 t0 -78.75 178.51 7.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.552 -0.749 . . . . 1.8 110.819 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -80.11 41.58 0.53 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.227 -0.442 . . . . 1.6200000000000001 111.236 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -139.76 10.87 2.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 1.6499999999999999 110.759 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 62.9 50.15 66.28 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.852 -0.69 . . . . 0.88 112.452 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -173.96 134.95 0.47 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.985 0.421 . . . . 1.8600000000000001 110.659 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 825' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -64.17 148.41 50.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.883 -0.599 . . . . 0.64000000000000001 110.778 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.599 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -136.93 176.56 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.96999999999999997 110.642 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 827' ' ' VAL . . . . . 0.402 HG12 ' HE2' ' A' ' 815' ' ' LYS . 0.2 OUTLIER -99.24 110.91 27.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.914 0.387 . . . . 0.56000000000000005 111.138 -179.774 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 5.9 tt -79.69 124.07 28.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.81000000000000005 110.869 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -69.87 -66.16 2.32 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.812 -0.709 . . . . 0.81000000000000005 112.453 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.02 -140.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.467 0.175 . . . . 1.3100000000000001 110.617 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.429 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 1.9 p30 -58.12 -18.72 27.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.779 0.323 . . . . 2.2000000000000002 111.048 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.419 ' O ' HG23 ' A' ' 836' ' ' VAL . 2.6 mt-10 -72.23 -68.14 0.49 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.261 -0.427 . . . . 2.21 110.715 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.88 -12.27 23.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.312 -0.404 . . . . 0.72999999999999998 110.668 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.611 ' CZ2' HG11 ' A' ' 785' ' ' VAL . 2.1 t-105 -85.23 -41.8 15.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.26000000000000001 110.249 179.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.553 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -68.33 -36.7 79.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.892 -0.594 . . . . 1.98 109.489 178.984 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 832' ' ' GLU . 64.5 t -70.62 -55.27 14.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.354 -0.839 . . . . 0.67000000000000004 109.913 179.016 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.21 -24.34 53.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.953 -0.567 . . . . 0.22 110.533 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.553 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 28.7 mtmt -71.42 -49.63 39.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 0.84999999999999998 110.366 179.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 839' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 0.5 OUTLIER -61.26 -21.91 64.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.977 -0.556 . . . . 1.95 110.214 179.424 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.6 ttp -77.79 -36.39 50.48 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.704 -0.68 . . . . 0.29999999999999999 110.454 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.877 HD11 HD23 ' A' ' 849' ' ' LEU . 17.2 mt -66.1 -48.8 69.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 0.46999999999999997 110.629 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.446 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.81 -30.5 71.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.165 -0.47 . . . . 0.48999999999999999 111.097 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 843' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 0.7 OUTLIER -69.27 5.86 1.16 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.154 -0.476 . . . . 1.6799999999999999 110.593 179.741 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.446 ' H ' ' C ' ' A' ' 842' ' ' ALA . 9.0 m-80 -143.2 19.36 1.92 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 1.96 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 62.06 9.96 3.4 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.115 -0.493 . . . . 1.99 111.346 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.33 174.36 10.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.499 -0.319 . . . . 2.2999999999999998 110.909 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -157.65 -32.63 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 1.98 110.84 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.614 ' HE1' HD12 ' A' ' 784' ' ' LEU . 2.3 m-85 -80.27 147.95 30.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 1.0900000000000001 110.86 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.877 HD23 HD11 ' A' ' 841' ' ' LEU . 0.6 OUTLIER -125.01 128.38 48.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 0.73999999999999999 111.011 -179.857 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.524 ' O ' HD13 ' A' ' 849' ' ' LEU . 6.0 m120 -79.15 160.08 27.15 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.173 -0.467 . . . . 1.52 110.978 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.797 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.1 mm -132.54 165.67 31.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.439 -0.346 . . . . 1.04 111.63 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.56 ' HB2' ' H ' ' A' ' 817' ' ' LYS . 21.2 ttp180 -51.6 -90.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 5.0899999999999999 111.118 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 853' ' ' LEU . . . . . 0.446 HD12 ' HB2' ' A' ' 781' ' ' PHE . 1.3 mt 50.77 24.74 1.83 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.692 0.282 . . . . 2.6000000000000001 111.634 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 854' ' ' TYR . . . . . 0.431 ' H ' ' HG2' ' A' ' 852' ' ' ARG . 18.3 p90 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.247 -0.882 . . . . 3.3900000000000001 110.912 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.578 -0.209 . . . . 9.0999999999999996 112.578 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 56.63 28.7 14.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.829 0.347 . . . . 8.1199999999999992 111.2 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -155.17 106.71 2.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 8.3399999999999999 110.891 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -117.88 -173.62 16.27 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.717 -0.754 . . . . 4.25 112.529 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 779' ' ' SER . . . . . 0.41 ' O ' ' HB3' ' A' ' 853' ' ' LEU . 1.4 m -118.35 10.04 12.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.931 0.396 . . . . 2.6099999999999999 110.872 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.515 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -120.72 -168.35 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 1.22 110.836 179.841 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.812 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.24 98.39 1.29 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.043 0.449 . . . . 0.93999999999999995 109.873 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.466 HG23 ' OD1' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -96.73 86.97 4.2 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.824 -0.626 . . . . 0.67000000000000004 110.678 -179.442 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.491 ' O ' HG23 ' A' ' 785' ' ' VAL . 0.2 OUTLIER -82.11 117.43 22.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.244 -0.889 . . . . 1.5700000000000001 110.991 -179.723 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.442 HD12 ' CE1' ' A' ' 848' ' ' PHE . 0.7 OUTLIER -63.12 110.93 2.0 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.085 0.469 . . . . 0.81000000000000005 110.299 179.672 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.72 HG11 ' HZ2' ' A' ' 834' ' ' TRP . 46.8 t -107.03 152.78 8.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.708 -0.678 . . . . 1.1799999999999999 111.703 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.402 ' N ' HG12 ' A' ' 785' ' ' VAL . 1.0 OUTLIER -101.05 172.04 7.26 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.803 -0.635 . . . . 1.3999999999999999 110.416 179.4 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.27 53.24 2.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.962 0.411 . . . . 2.8500000000000001 110.622 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.2 p -164.19 -27.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.991 -0.55 . . . . 0.33000000000000002 111.097 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 789' ' ' TRP . . . . . 0.559 ' CE3' HG13 ' A' ' 785' ' ' VAL . 38.3 m0 -53.23 126.01 19.54 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.092 -0.504 . . . . 0.29999999999999999 112.14 -179.371 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.13 170.11 9.76 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.626 -0.879 . . . . 1.8899999999999999 108.626 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.425 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 49.8 t80 -56.15 -25.27 45.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.97 0.414 . . . . 0.63 110.161 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 796' ' ' MET . 26.2 t70 -72.6 -59.82 2.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.912 -0.585 . . . . 2.0499999999999998 109.933 178.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.29 -32.68 64.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.284 -0.416 . . . . 1.0700000000000001 110.125 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.599 HD22 ' CE2' ' A' ' 834' ' ' TRP . 22.3 tp -64.31 -53.38 49.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.951 -0.568 . . . . 0.93000000000000005 110.789 179.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.694 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 17.4 mm -56.34 -30.81 31.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.768 -0.651 . . . . 0.32000000000000001 111.689 -179.443 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 2.6 mtt -68.85 -56.31 8.36 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.234 -0.186 . . . . 1.53 110.964 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -52.03 -51.36 57.95 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.232 0.539 . . . . 0.38 110.131 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.511 ' O ' HG12 ' A' ' 802' ' ' ILE . 79.5 mt -58.76 -52.78 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-N 115.505 -0.77 . . . . 0.5 110.797 179.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.694 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t-20 -50.49 -31.73 16.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.801 -0.636 . . . . 0.81000000000000005 111.536 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.54 -34.19 67.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.441 -0.345 . . . . 0.97999999999999998 110.802 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.54 8.49 44.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 2.25 111.99 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.568 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 3.3 pt -129.14 -19.1 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 111.824 0.305 . . . . 0.75 111.824 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 1.6 m -121.54 -79.23 0.61 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.577 -0.283 . . . . 1.53 111.044 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 52.79 -164.88 0.08 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.846 0.355 . . . . 2.8300000000000001 111.178 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 3.2 t -153.72 120.32 5.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.19 -0.459 . . . . 4.2000000000000002 110.804 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -165.7 -55.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.459 . . . . 7.6900000000000004 110.95 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -95.98 -79.78 0.44 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.152 -0.477 . . . . 6.2199999999999998 111.046 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -93.18 -162.5 0.94 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.347 -0.388 . . . . 6.8300000000000001 110.849 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -66.93 -172.89 0.2 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 6.4100000000000001 110.998 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 5.0 mt -96.88 -65.4 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.1 -0.5 . . . . 4.7800000000000002 110.867 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 8.0 t 50.54 65.88 6.23 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.013 -0.54 . . . . 1.8 111.168 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 812' ' ' PRO . . . . . 0.413 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 35.1 Cg_exo -61.34 144.27 98.35 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.592 2.195 . . . . 0.94999999999999996 112.32 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 1.9 mt -109.48 159.58 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 1.9399999999999999 110.8 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 9.5 p -126.42 -51.17 1.51 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.433 -0.348 . . . . 1.1599999999999999 111.611 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.67 125.68 29.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.9 0.381 . . . . 2.6899999999999999 111.033 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.5 pp -146.59 160.63 10.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.83999999999999997 111.339 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.664 ' HG3' ' HD2' ' A' ' 852' ' ' ARG . 16.5 mmtt -102.51 164.12 11.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.995 -0.548 . . . . 0.84999999999999998 110.52 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.556 ' CE1' HG23 ' A' ' 826' ' ' VAL . 12.2 p90 -145.77 153.4 40.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.948 0.404 . . . . 0.70999999999999996 111.312 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 819' ' ' GLN . . . . . 0.471 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.6 OUTLIER -76.72 104.76 7.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.924 -0.58 . . . . 1.9099999999999999 110.751 -179.611 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.537 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.8 t70 -79.26 173.98 12.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.581 -0.736 . . . . 1.8 111.055 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 821' ' ' GLU . . . . . 0.454 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 6.7 pt-20 -74.1 9.42 1.6 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.14 -0.482 . . . . 1.6200000000000001 111.446 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.72 14.47 29.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.386 -0.37 . . . . 1.6499999999999999 110.802 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 59.07 46.93 93.01 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.751 -0.738 . . . . 0.88 112.376 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -174.5 136.43 0.45 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.025 0.44 . . . . 1.8600000000000001 110.546 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.474 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 91.6 m-85 -63.21 140.7 58.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.751 -0.659 . . . . 0.64000000000000001 110.915 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.556 HG23 ' CE1' ' A' ' 818' ' ' TYR . 2.4 m -130.36 -179.6 3.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.082 -0.508 . . . . 0.96999999999999997 110.648 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.85 112.7 31.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.05 0.452 . . . . 0.56000000000000005 111.388 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.405 ' HB2' ' CD1' ' A' ' 818' ' ' TYR . 0.7 OUTLIER -81.52 123.89 29.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.81000000000000005 110.856 179.892 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -63.5 -65.74 2.91 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.806 -0.711 . . . . 0.81000000000000005 112.443 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 830' ' ' SER . . . . . 0.423 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 2.1 p -173.97 -131.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.241 -0.281 . . . . 1.3100000000000001 110.241 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.423 ' H ' ' HB2' ' A' ' 830' ' ' SER . 4.8 p-10 -64.03 -14.24 52.82 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.811 0.338 . . . . 2.2000000000000002 110.743 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.571 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.0 OUTLIER -74.34 -69.84 0.43 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.141 -0.482 . . . . 2.21 110.697 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 833' ' ' ASP . . . . . 0.404 ' HB2' ' HG ' ' A' ' 828' ' ' LEU . 3.7 m-20 -59.69 -14.53 14.43 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.149 -0.478 . . . . 0.72999999999999998 110.395 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.72 ' HZ2' HG11 ' A' ' 785' ' ' VAL . 1.3 t-105 -81.18 -43.54 19.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.127 -0.488 . . . . 0.26000000000000001 110.094 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.756 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -67.3 -35.93 80.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.025 -0.534 . . . . 1.98 109.78 178.927 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 832' ' ' GLU . 21.8 t -71.22 -55.74 12.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.398 -0.819 . . . . 0.67000000000000004 110.274 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.75 -24.15 55.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.005 -0.543 . . . . 0.22 110.591 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.756 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 31.5 mtmt -71.95 -42.26 66.8 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.163 -0.471 . . . . 0.84999999999999998 110.293 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -65.45 -27.63 68.65 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.103 -0.498 . . . . 1.95 110.014 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 840' ' ' MET . . . . . 0.454 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 12.4 ttp -72.27 -35.13 68.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.743 -0.662 . . . . 0.29999999999999999 110.343 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.713 HD11 HD23 ' A' ' 849' ' ' LEU . 50.4 mt -70.47 -51.97 25.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.816 -0.629 . . . . 0.46999999999999997 110.811 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.42 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -75.69 -0.63 21.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.48999999999999999 111.359 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -65.85 -0.75 2.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.992 0.425 . . . . 1.6799999999999999 110.299 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 842' ' ' ALA . 69.8 m-80 -150.67 -71.39 0.17 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.852 -0.613 . . . . 1.96 110.507 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.38 27.18 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.885 -0.598 . . . . 1.99 111.0 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 846' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' A' ' 841' ' ' LEU . 4.5 mt-10 -87.61 156.29 19.56 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.87 0.367 . . . . 2.2999999999999998 111.038 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -145.85 -29.07 0.42 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.039 -0.528 . . . . 1.98 110.956 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.442 ' CE1' HD12 ' A' ' 784' ' ' LEU . 36.6 m-85 -79.8 157.29 27.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.183 -0.462 . . . . 1.0900000000000001 110.922 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.713 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -141.24 126.48 18.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.73999999999999999 110.852 179.815 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.471 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 76.0 m-20 -77.47 161.2 28.13 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.362 -0.381 . . . . 1.52 111.171 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.812 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.6 OUTLIER -131.29 170.53 19.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 CA-C-N 116.346 -0.388 . . . . 1.04 111.527 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.664 ' HD2' ' HG3' ' A' ' 817' ' ' LYS . 45.7 ttt-85 -53.35 -87.23 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.235 -0.439 . . . . 5.0899999999999999 110.915 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 853' ' ' LEU . . . . . 0.41 ' HB3' ' O ' ' A' ' 779' ' ' SER . 0.9 OUTLIER 55.46 18.07 2.49 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.201 -0.454 . . . . 2.6000000000000001 111.455 179.757 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 854' ' ' TYR . . . . . 0.475 ' CD1' ' HG3' ' A' ' 852' ' ' ARG . 12.1 p90 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.211 -0.9 . . . . 3.3900000000000001 110.903 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 112.494 -0.242 . . . . 9.0999999999999996 112.494 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -81.23 110.96 17.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.735 0.302 . . . . 8.1199999999999992 111.122 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 2.3 mmm 56.82 -160.92 0.21 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.104 -0.498 . . . . 8.3399999999999999 111.04 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 122.94 -5.27 9.69 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.866 -0.683 . . . . 4.25 112.47 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 779' ' ' SER . . . . . 0.423 ' O ' ' HB3' ' A' ' 853' ' ' LEU . 1.0 OUTLIER -105.74 -41.98 5.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.823 0.344 . . . . 2.6099999999999999 110.908 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.421 HG22 ' H ' ' A' ' 851' ' ' ILE . 0.1 OUTLIER -132.44 -162.51 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.135 -0.484 . . . . 1.22 110.973 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.706 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.68 91.11 1.28 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.05 0.452 . . . . 0.93999999999999995 110.113 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.478 HG23 ' CG ' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -98.33 92.89 5.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 0.67000000000000004 111.106 -179.414 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.64 157.77 17.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.688 -0.687 . . . . 1.5700000000000001 110.746 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.75 112.78 23.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.417 -0.356 . . . . 0.81000000000000005 110.381 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.643 HG11 ' CZ2' ' A' ' 834' ' ' TRP . 23.5 t -107.6 153.63 8.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.035 -0.53 . . . . 1.1799999999999999 111.515 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.406 ' N ' HG12 ' A' ' 785' ' ' VAL . 0.2 OUTLIER -104.82 175.37 5.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.883 -0.598 . . . . 1.3999999999999999 110.453 179.509 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -90.0 55.63 3.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.991 0.424 . . . . 2.8500000000000001 110.734 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.5 p -168.07 -26.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.052 -0.522 . . . . 0.33000000000000002 111.156 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 789' ' ' TRP . . . . . 0.575 ' CE3' HG13 ' A' ' 785' ' ' VAL . 36.1 m0 -52.42 125.42 16.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.29999999999999999 111.767 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.68 169.78 10.23 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.808 -0.812 . . . . 1.8899999999999999 108.808 178.353 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.448 ' O ' HG12 ' A' ' 795' ' ' ILE . 10.1 t80 -55.62 -25.02 36.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.984 0.421 . . . . 0.63 109.912 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.593 ' O ' ' HG3' ' A' ' 796' ' ' MET . 4.6 m-20 -73.22 -61.18 1.91 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.896 -0.593 . . . . 2.0499999999999998 109.679 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.94 -32.05 60.97 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 116.229 -0.441 . . . . 1.0700000000000001 110.321 179.206 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.569 HD22 ' CE2' ' A' ' 834' ' ' TRP . 23.2 tp -64.42 -52.78 56.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.814 -0.63 . . . . 0.93000000000000005 110.506 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.663 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 21.2 mm -59.55 -30.83 45.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.697 -0.683 . . . . 0.32000000000000001 111.571 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.593 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 3.2 mtt -68.56 -53.76 20.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.61 0.243 . . . . 1.53 110.736 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.09 -49.57 66.17 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.082 0.467 . . . . 0.38 110.285 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.409 HG22 HG12 ' A' ' 802' ' ' ILE . 56.5 mt -60.83 -52.84 56.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.623 -0.717 . . . . 0.5 110.546 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.663 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 2.6 t30 -51.81 -23.71 5.07 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.604 -0.725 . . . . 0.81000000000000005 111.548 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.46 -33.8 31.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.384 -0.371 . . . . 0.97999999999999998 110.676 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -94.81 4.17 54.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.061 -0.518 . . . . 2.25 111.454 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.576 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.1 pt -124.6 -35.04 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 111.725 0.269 . . . . 0.75 111.725 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 803' ' ' SER . . . . . 0.467 ' N ' HG13 ' A' ' 802' ' ' ILE . 23.0 p -136.45 81.39 1.88 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.946 0.403 . . . . 1.53 111.071 -179.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -87.69 122.98 32.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.917 -0.583 . . . . 2.8300000000000001 110.73 179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 805' ' ' THR . . . . . 0.426 HG22 ' H ' ' A' ' 806' ' ' HIS . 0.2 OUTLIER 62.98 169.45 0.14 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.225 -0.443 . . . . 4.2000000000000002 111.252 -179.748 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 806' ' ' HIS . . . . . 0.426 ' H ' HG22 ' A' ' 805' ' ' THR . 2.5 t-80 -80.5 -63.55 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 7.6900000000000004 110.681 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 3.5 t30 53.82 80.83 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 6.2199999999999998 110.919 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 31.9 m120 61.58 -85.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.035 -0.53 . . . . 6.8300000000000001 111.074 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -147.33 144.56 28.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.879 0.371 . . . . 6.4100000000000001 111.041 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -138.1 178.35 4.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.034 -0.53 . . . . 4.7800000000000002 111.001 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 1.5 m -137.63 88.16 16.71 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.33 -0.396 . . . . 1.8 111.234 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.22 -174.45 1.2 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.528 2.152 . . . . 0.94999999999999996 112.02 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 2.8 pt -147.79 139.07 17.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.309 -0.405 . . . . 1.9399999999999999 111.326 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 72.0 p -114.18 -46.32 3.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 1.1599999999999999 111.078 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -99.1 127.28 45.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 2.6899999999999999 110.861 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.1 pp -153.82 171.51 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.173 -0.467 . . . . 0.83999999999999997 111.229 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.678 ' HG3' ' HD3' ' A' ' 852' ' ' ARG . 13.0 mmtt -101.49 175.07 5.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.84999999999999998 110.821 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.662 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 27.5 p90 -145.6 156.75 43.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.225 -0.443 . . . . 0.70999999999999996 111.08 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 819' ' ' GLN . . . . . 0.523 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.8 OUTLIER -86.93 106.49 17.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.228 0.537 . . . . 1.9099999999999999 110.59 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -79.4 177.76 8.61 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.426 -0.806 . . . . 1.8 110.886 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 821' ' ' GLU . . . . . 0.507 ' HG2' ' HG3' ' A' ' 840' ' ' MET . 0.2 OUTLIER -80.69 13.2 2.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.121 -0.49 . . . . 1.6200000000000001 111.088 -179.852 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -99.75 -11.82 20.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 1.6499999999999999 110.743 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 94.39 11.36 57.28 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.705 -0.759 . . . . 0.88 112.618 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -128.5 -153.49 0.57 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.997 0.427 . . . . 1.8600000000000001 110.612 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.475 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 63.0 m-85 -133.26 134.94 44.58 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.918 -0.583 . . . . 0.64000000000000001 111.195 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.662 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 1.5 t -111.32 173.18 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 116.052 -0.522 . . . . 0.96999999999999997 110.946 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 827' ' ' VAL . . . . . 0.586 ' H ' HG12 ' A' ' 826' ' ' VAL . 6.1 t -99.45 107.06 19.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.797 0.332 . . . . 0.56000000000000005 111.074 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 7.5 tp -79.76 104.92 10.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.81000000000000005 110.672 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.11 -63.66 3.68 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.831 -0.7 . . . . 0.81000000000000005 112.712 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 830' ' ' SER . . . . . 0.521 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -166.64 -142.45 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.465 0.174 . . . . 1.3100000000000001 110.571 -179.795 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.521 ' H ' ' HB3' ' A' ' 830' ' ' SER . 4.6 t0 -59.66 -14.1 12.45 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.739 0.304 . . . . 2.2000000000000002 110.925 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.405 ' O ' HG23 ' A' ' 836' ' ' VAL . 2.9 mt-10 -73.8 -70.88 0.35 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.289 -0.414 . . . . 2.21 110.733 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -63.31 -11.91 25.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.72999999999999998 110.357 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.643 ' CZ2' HG11 ' A' ' 785' ' ' VAL . 1.5 t-105 -83.1 -39.69 20.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.18 -0.464 . . . . 0.26000000000000001 109.898 179.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.719 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -69.9 -36.36 75.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.893 -0.594 . . . . 1.98 109.936 178.865 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 832' ' ' GLU . 44.2 t -72.01 -54.54 16.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.419 -0.81 . . . . 0.67000000000000004 110.296 179.359 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.39 -24.85 61.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.099 -0.501 . . . . 0.22 110.462 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.719 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.0 mtmt -69.77 -43.46 72.16 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.101 -0.5 . . . . 0.84999999999999998 110.367 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -64.41 -26.21 68.36 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 1.95 110.031 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 840' ' ' MET . . . . . 0.507 ' HG3' ' HG2' ' A' ' 821' ' ' GLU . 7.6 ttp -72.92 -36.5 67.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.667 -0.697 . . . . 0.29999999999999999 110.155 179.392 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.592 HD11 HD23 ' A' ' 849' ' ' LEU . 3.2 mt -68.59 -44.28 74.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.585 . . . . 0.46999999999999997 110.773 179.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.423 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.46 -23.51 66.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.48999999999999999 111.179 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.8 3.81 1.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 1.6799999999999999 110.591 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 842' ' ' ALA . 38.6 m-80 -151.31 16.69 0.73 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.968 -0.56 . . . . 1.96 110.692 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 24.0 t30 58.59 19.68 6.91 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.01 -0.541 . . . . 1.99 111.102 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.16 161.06 29.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 2.2999999999999998 111.024 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -152.54 10.25 0.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 1.98 110.696 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.416 ' HB3' HG22 ' A' ' 782' ' ' THR . 74.6 m-85 -112.97 125.91 54.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.957 -0.565 . . . . 1.0900000000000001 110.765 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.592 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -122.06 119.08 30.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.73999999999999999 111.002 -179.688 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.523 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 23.2 m-20 -82.17 174.68 10.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 1.52 111.178 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.706 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.6 mm -133.29 165.25 32.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.165 -0.471 . . . . 1.04 111.167 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.678 ' HD3' ' HG3' ' A' ' 817' ' ' LYS . 10.3 ttp180 -47.92 -89.27 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.476 -0.329 . . . . 5.0899999999999999 111.143 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 853' ' ' LEU . . . . . 0.423 ' HB3' ' O ' ' A' ' 779' ' ' SER . 0.4 OUTLIER 49.79 24.4 1.25 Allowed 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.287 -0.415 . . . . 2.6000000000000001 111.47 179.917 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 854' ' ' TYR . . . . . 0.51 ' CD1' ' HG3' ' A' ' 852' ' ' ARG . 14.9 p90 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.302 -0.856 . . . . 3.3900000000000001 110.947 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.175 0 N-CA-C 112.479 -0.248 . . . . 9.0999999999999996 112.479 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -130.56 97.6 4.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.853 0.359 . . . . 8.1199999999999992 110.985 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.78 -32.15 2.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 8.3399999999999999 110.887 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 153.89 167.45 16.1 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.845 -0.693 . . . . 4.25 112.545 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 18.3 t -112.63 -39.75 4.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.671 0.272 . . . . 2.6099999999999999 110.968 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.34 -164.74 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.264 -0.425 . . . . 1.22 110.978 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.774 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -144.21 84.15 1.75 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.254 -0.43 . . . . 0.93999999999999995 109.971 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.524 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.3 OUTLIER -98.5 102.64 14.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.67000000000000004 111.602 -179.258 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.54 -164.87 1.19 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.009 -0.541 . . . . 1.5700000000000001 110.342 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.412 HD12 ' CE1' ' A' ' 848' ' ' PHE . 0.6 OUTLIER -119.04 108.83 15.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.012 0.434 . . . . 0.81000000000000005 110.151 179.325 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.476 HG13 ' CE3' ' A' ' 789' ' ' TRP . 90.3 t -101.88 147.11 9.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.664 -0.698 . . . . 1.1799999999999999 111.155 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -103.98 168.84 8.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.257 -0.429 . . . . 1.3999999999999999 110.953 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.82 56.53 3.93 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.193 0.52 . . . . 2.8500000000000001 110.488 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 1.7 p -164.32 -27.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.515 -0.766 . . . . 0.33000000000000002 110.49 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 789' ' ' TRP . . . . . 0.476 ' CE3' HG13 ' A' ' 785' ' ' VAL . 30.3 m0 -50.52 124.25 10.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.498 -0.774 . . . . 0.29999999999999999 111.897 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 790' ' ' ASN . . . . . 0.753 ' ND2' ' H ' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -93.43 162.62 13.91 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.916 -0.772 . . . . 1.8899999999999999 108.916 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -44.04 -30.18 0.7 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.824 0.345 . . . . 0.63 111.395 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.753 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 13.1 t0 -76.69 -59.01 2.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.233 -0.44 . . . . 2.0499999999999998 110.143 179.156 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -53.12 -21.69 5.21 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.553 0.692 . . . . 1.0700000000000001 109.271 178.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.443 HD13 ' N ' ' A' ' 795' ' ' ILE . 1.3 tm? -74.19 -75.58 0.15 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.766 -1.106 . . . . 0.93000000000000005 109.988 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.631 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 23.4 mm -46.44 -32.38 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.032 -0.985 . . . . 0.32000000000000001 111.98 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.624 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 26.1 mtm -69.93 -42.23 73.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.711 0.291 . . . . 1.53 110.836 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -63.73 -47.68 80.09 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.012 0.434 . . . . 0.38 110.101 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 802' ' ' ILE . 31.2 mt -62.74 -50.23 80.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.711 -0.677 . . . . 0.5 110.176 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.631 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 4.2 t30 -52.19 -32.63 37.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.6 -0.727 . . . . 0.81000000000000005 111.242 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 800' ' ' SER . . . . . 0.513 ' O ' ' HB2' ' A' ' 804' ' ' ASN . 0.2 OUTLIER -72.87 -32.69 65.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.97999999999999998 110.79 179.838 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 801' ' ' LYS . . . . . 0.457 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 4.4 mmtt -88.05 -5.06 58.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.093 -0.503 . . . . 2.25 111.374 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.631 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.3 pp -111.79 -21.65 5.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.498 -0.319 . . . . 0.75 111.423 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.07 91.28 1.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.342 -0.39 . . . . 1.53 111.085 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 804' ' ' ASN . . . . . 0.513 ' HB2' ' O ' ' A' ' 800' ' ' SER . 5.0 t-20 -127.47 -40.7 1.76 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.178 -0.464 . . . . 2.8300000000000001 110.843 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 44.1 p -132.08 -168.89 2.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 4.2000000000000002 110.9 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -67.86 89.42 0.28 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.289 -0.414 . . . . 7.6900000000000004 110.72 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -112.59 -163.0 0.82 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.077 -0.511 . . . . 6.2199999999999998 110.789 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -66.1 -17.9 65.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.29 -0.414 . . . . 6.8300000000000001 111.121 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -129.91 175.93 8.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 6.4100000000000001 111.056 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -137.29 -41.96 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.174 -0.466 . . . . 4.7800000000000002 111.1 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 1.4 p -80.5 133.05 56.89 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 1.8 110.775 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 812' ' ' PRO . . . . . 0.533 ' CB ' HD22 ' A' ' 799' ' ' ASN . 56.7 Cg_endo -70.24 -169.42 0.35 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.584 2.189 . . . . 0.94999999999999996 112.392 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.559 HG12 HD13 ' A' ' 802' ' ' ILE . 11.6 pt -135.59 -178.22 2.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 1.9399999999999999 111.084 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 8.9 p -142.73 -66.32 0.39 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.093 -0.503 . . . . 1.1599999999999999 111.097 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.03 129.68 34.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.148 -0.478 . . . . 2.6899999999999999 110.66 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 816' ' ' ILE . . . . . 0.504 HG22 ' HD3' ' A' ' 852' ' ' ARG . 1.3 pp -146.05 161.53 11.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.065 0.459 . . . . 0.83999999999999997 111.495 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.808 ' HB2' ' HB3' ' A' ' 852' ' ' ARG . 17.5 mmtt -102.31 160.03 14.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.746 -0.661 . . . . 0.84999999999999998 110.496 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.605 ' CE1' HG23 ' A' ' 826' ' ' VAL . 11.0 p90 -145.31 156.49 43.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.973 0.416 . . . . 0.70999999999999996 111.307 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -78.59 107.01 10.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.832 -0.622 . . . . 1.9099999999999999 110.738 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.418 ' HB2' HG22 ' A' ' 826' ' ' VAL . 2.7 t0 -78.27 176.41 9.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.631 -0.713 . . . . 1.8 110.578 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -76.04 4.76 7.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.438 . . . . 1.6200000000000001 111.409 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -102.65 16.01 27.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.408 -0.36 . . . . 1.6499999999999999 110.833 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 57.73 50.56 64.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.822 -0.704 . . . . 0.88 112.358 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -173.1 132.89 0.51 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.794 0.331 . . . . 1.8600000000000001 110.635 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.475 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 71.6 m-85 -61.03 142.55 56.54 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.097 -0.501 . . . . 0.64000000000000001 110.682 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.605 HG23 ' CE1' ' A' ' 818' ' ' TYR . 2.4 m -134.66 179.39 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.297 -0.41 . . . . 0.96999999999999997 111.037 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -99.14 113.11 33.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.969 0.414 . . . . 0.56000000000000005 111.371 -179.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.24 120.81 24.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.825 -0.625 . . . . 0.81000000000000005 110.835 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.12 -68.27 1.71 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.844 -0.693 . . . . 0.81000000000000005 112.606 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -170.8 -144.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.485 -0.191 . . . . 1.3100000000000001 110.485 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -53.77 -25.03 17.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.74 0.305 . . . . 2.2000000000000002 111.081 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.502 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.1 OUTLIER -66.65 -66.59 0.53 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.233 -0.439 . . . . 2.21 110.656 179.751 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.22 -12.14 37.89 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.277 -0.42 . . . . 0.72999999999999998 110.348 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.467 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 3.6 t-105 -81.88 -40.02 23.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.26000000000000001 109.808 178.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.698 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 11.6 m-80 -71.02 -32.04 68.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 1.98 109.883 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 832' ' ' GLU . 39.7 t -75.34 -53.77 15.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.715 -0.675 . . . . 0.67000000000000004 109.818 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -56.33 -28.11 57.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.996 -0.547 . . . . 0.22 110.315 179.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.698 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.1 mtmt -71.86 -48.41 46.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.854 -0.612 . . . . 0.84999999999999998 110.267 179.412 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.12 -22.49 66.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.944 -0.571 . . . . 1.95 110.104 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 1.2 ttp -77.54 -35.16 53.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.811 -0.631 . . . . 0.29999999999999999 110.266 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.772 HD11 HD23 ' A' ' 849' ' ' LEU . 10.2 mt -66.33 -48.86 68.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.917 -0.583 . . . . 0.46999999999999997 110.805 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.443 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.51 -29.69 70.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.414 . . . . 0.48999999999999999 111.017 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -70.63 8.59 0.82 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.984 -0.553 . . . . 1.6799999999999999 110.792 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.443 ' H ' ' C ' ' A' ' 842' ' ' ALA . 40.4 m-80 -148.55 19.63 1.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 1.96 111.005 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 62.77 10.84 4.49 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.206 -0.452 . . . . 1.99 111.064 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 846' ' ' GLU . . . . . 0.47 ' HB3' HD23 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -86.38 147.1 26.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 2.2999999999999998 110.859 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.45 -18.91 1.45 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 1.98 110.931 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.524 ' HB3' HG22 ' A' ' 782' ' ' THR . 25.2 m-85 -87.96 147.02 25.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.278 -0.419 . . . . 1.0900000000000001 110.764 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.772 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -124.03 133.49 53.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.905 0.384 . . . . 0.73999999999999999 111.321 -179.498 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.457 ' O ' HD13 ' A' ' 849' ' ' LEU . 29.3 m-80 -92.48 157.75 16.4 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.989 -0.55 . . . . 1.52 110.747 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.774 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -122.92 167.39 16.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.465 -0.334 . . . . 1.04 111.82 -179.479 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.808 ' HB3' ' HB2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -47.84 -73.25 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.886 -0.597 . . . . 5.0899999999999999 111.515 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 59.94 35.93 21.67 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.044 -0.525 . . . . 2.6000000000000001 110.659 -179.605 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.171 -0.918 . . . . 3.3900000000000001 110.799 179.922 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.098 0 N-CA-C 112.371 -0.292 . . . . 9.0999999999999996 112.371 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -94.3 -49.29 5.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.764 0.316 . . . . 8.1199999999999992 111.131 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.96 103.34 15.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.223 -0.444 . . . . 8.3399999999999999 110.715 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 173.52 131.34 1.38 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.861 -0.685 . . . . 4.25 112.41 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 779' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 853' ' ' LEU . 0.4 OUTLIER -156.15 -29.1 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.807 0.337 . . . . 2.6099999999999999 110.871 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.422 HG23 ' HZ ' ' A' ' 825' ' ' PHE . 0.0 OUTLIER -139.49 -174.74 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.238 -0.437 . . . . 1.22 110.877 -179.951 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 1.009 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -150.83 89.72 1.56 Allowed 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.594 -0.521 . . . . 0.93999999999999995 109.594 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.1 OUTLIER -97.99 110.6 23.15 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.816 -0.629 . . . . 0.67000000000000004 111.473 -179.013 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.524 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -110.6 -167.67 1.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.801 -0.636 . . . . 1.5700000000000001 110.606 179.765 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.57 109.24 18.67 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.027 -0.533 . . . . 0.81000000000000005 110.194 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.424 HG21 ' HH2' ' A' ' 834' ' ' TRP . 27.9 m -105.79 172.73 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 1.1799999999999999 111.462 -179.089 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -129.4 158.43 39.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.943 -0.571 . . . . 1.3999999999999999 110.875 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -9.56 51.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 2.8500000000000001 110.959 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.8 p -95.05 -24.97 4.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.884 -0.598 . . . . 0.33000000000000002 110.762 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 27.0 m0 -58.41 124.72 20.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.738 -0.665 . . . . 0.29999999999999999 111.854 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 790' ' ' ASN . . . . . 0.85 HD21 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -98.06 161.35 13.76 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.916 -0.772 . . . . 1.8899999999999999 108.916 178.394 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.46 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 53.5 t80 -44.36 -33.13 1.54 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.829 0.347 . . . . 0.63 111.138 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.85 ' HB3' HD21 ' A' ' 790' ' ' ASN . 35.7 t70 -69.52 -55.21 10.84 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.669 -0.493 . . . . 2.0499999999999998 109.669 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 793' ' ' ASP . . . . . 0.631 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.6 OUTLIER -58.74 -23.65 60.26 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.167 0.508 . . . . 1.0700000000000001 110.31 179.124 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.551 HD22 ' CE2' ' A' ' 834' ' ' TRP . 34.5 tp -74.05 -54.35 8.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.62 -0.718 . . . . 0.93000000000000005 110.367 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.68 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 32.0 mm -57.41 -31.45 38.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.593 -0.73 . . . . 0.32000000000000001 111.74 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.681 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 33.4 mtm -68.14 -50.23 56.0 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.965 -0.294 . . . . 1.53 110.417 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.72 -52.64 61.83 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.026 0.441 . . . . 0.38 109.99 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.68 -51.4 72.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.731 -0.668 . . . . 0.5 110.61 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.68 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.7 OUTLIER -57.15 -24.39 53.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.61 -0.723 . . . . 0.81000000000000005 111.199 -179.754 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 34.6 m -79.8 -26.72 40.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.108 -0.496 . . . . 0.97999999999999998 110.644 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 801' ' ' LYS . . . . . 0.504 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -98.91 -3.97 33.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.092 -0.503 . . . . 2.25 111.19 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.594 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.2 pt -116.69 -25.52 3.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.76 0.314 . . . . 0.75 111.437 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 803' ' ' SER . . . . . 0.448 ' N ' HG13 ' A' ' 802' ' ' ILE . 0.3 OUTLIER -151.54 80.94 1.29 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 1.53 111.134 -179.844 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -170.92 -21.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.259 -0.428 . . . . 2.8300000000000001 111.204 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 2.7 t -156.39 -17.06 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.359 -0.382 . . . . 4.2000000000000002 111.355 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -106.21 134.61 49.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.33 -0.395 . . . . 7.6900000000000004 110.953 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -108.9 65.64 0.62 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.279 -0.419 . . . . 6.2199999999999998 110.935 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -108.72 0.11 20.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 6.8300000000000001 110.797 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -144.51 -168.25 2.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.963 -0.562 . . . . 6.4100000000000001 110.605 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 6.8 mt -111.02 -55.43 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.434 -0.348 . . . . 4.7800000000000002 111.296 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 32.6 m -129.63 151.47 78.1 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.351 -0.386 . . . . 1.8 110.969 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 812' ' ' PRO . . . . . 0.426 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 46.3 Cg_exo -56.87 175.35 0.31 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.628 2.219 . . . . 0.94999999999999996 112.161 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 1.4 pp -138.77 158.16 30.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.296 -0.411 . . . . 1.9399999999999999 111.277 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 29.7 p -115.68 -46.35 2.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.273 -0.422 . . . . 1.1599999999999999 111.182 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -80.73 139.61 36.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 2.6899999999999999 110.706 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -153.26 175.4 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 121.022 0.439 . . . . 0.83999999999999997 111.452 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.626 ' N ' ' HG3' ' A' ' 852' ' ' ARG . 16.2 mmtt -130.88 126.54 36.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.798 -0.637 . . . . 0.84999999999999998 110.188 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.608 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 9.1 p90 -96.74 165.2 12.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.808 0.337 . . . . 0.70999999999999996 111.057 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 819' ' ' GLN . . . . . 0.581 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 5.6 tp60 -103.28 113.31 26.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.099 0.475 . . . . 1.9099999999999999 110.576 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -78.96 170.3 16.9 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.556 -0.747 . . . . 1.8 110.941 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.7 9.8 3.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.128 -0.487 . . . . 1.6200000000000001 111.251 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -105.72 6.61 32.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 1.6499999999999999 111.024 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 67.28 57.31 9.5 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.791 -0.719 . . . . 0.88 112.469 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -170.29 131.34 0.96 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.946 0.403 . . . . 1.8600000000000001 110.662 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.422 ' HZ ' HG23 ' A' ' 780' ' ' ILE . 34.3 m-85 -72.21 131.21 42.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.882 -0.599 . . . . 0.64000000000000001 110.942 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.608 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -115.14 166.58 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 115.787 -0.642 . . . . 0.96999999999999997 111.086 -179.64 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.24 103.49 14.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 0.56000000000000005 110.618 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.0 tt -79.5 119.01 21.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.103 -0.499 . . . . 0.81000000000000005 110.916 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -65.58 -66.46 2.42 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.875 -0.678 . . . . 0.81000000000000005 112.775 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 830' ' ' SER . . . . . 0.448 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 2.5 m -167.54 -135.16 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 110.463 -0.199 . . . . 1.3100000000000001 110.463 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.448 ' H ' ' HB3' ' A' ' 830' ' ' SER . 1.0 OUTLIER -57.81 -22.46 47.56 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.801 0.334 . . . . 2.2000000000000002 110.941 179.797 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -68.1 -70.05 0.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 2.21 110.877 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.13 -13.91 20.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.35 -0.386 . . . . 0.72999999999999998 110.511 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.551 ' CE2' HD22 ' A' ' 794' ' ' LEU . 0.4 OUTLIER -80.06 -44.96 19.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.969 -0.56 . . . . 0.26000000000000001 109.941 179.249 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.688 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 18.7 m-80 -68.11 -30.19 69.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.08 -0.509 . . . . 1.98 110.061 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 65.1 t -76.39 -56.02 9.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.735 -0.666 . . . . 0.67000000000000004 110.325 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.28 -27.59 64.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.006 -0.543 . . . . 0.22 110.611 179.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.688 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 25.1 mtmt -69.21 -45.27 70.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.183 -0.462 . . . . 0.84999999999999998 110.171 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.99 -26.17 65.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.079 -0.509 . . . . 1.95 110.082 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 19.8 ttp -74.54 -35.32 63.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.632 -0.713 . . . . 0.29999999999999999 110.319 179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.877 HD11 HD23 ' A' ' 849' ' ' LEU . 18.7 mt -66.67 -55.94 12.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.056 -0.52 . . . . 0.46999999999999997 110.646 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -61.44 -20.3 62.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.038 -0.528 . . . . 0.48999999999999999 111.235 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.13 2.21 1.66 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 1.6799999999999999 110.403 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.441 ' H ' ' C ' ' A' ' 842' ' ' ALA . 54.0 m-80 -153.7 23.15 0.52 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.902 -0.59 . . . . 1.96 110.769 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.9 t30 59.24 21.59 9.77 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.076 -0.511 . . . . 1.99 111.036 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -82.85 142.09 31.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 2.2999999999999998 110.867 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 4.05 4.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 1.98 111.044 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.524 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 4.5 m-85 -104.0 126.17 50.92 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.24 -0.436 . . . . 1.0900000000000001 110.94 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.877 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -119.06 127.66 53.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 0.73999999999999999 111.116 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.581 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 17.2 m-20 -86.0 156.21 20.54 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.962 -0.563 . . . . 1.52 110.721 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 1.009 HD12 ' HB3' ' A' ' 781' ' ' PHE . 1.7 mt -130.33 170.23 19.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.753 0.311 . . . . 1.04 111.835 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.628 ' HG2' ' HD2' ' A' ' 854' ' ' TYR . 0.5 OUTLIER -37.66 -83.44 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.9 -0.591 . . . . 5.0899999999999999 112.088 -179.422 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 853' ' ' LEU . . . . . 0.504 ' HB3' ' O ' ' A' ' 779' ' ' SER . 0.2 OUTLIER 55.38 36.3 26.81 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.277 -0.42 . . . . 2.6000000000000001 110.646 -179.433 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 854' ' ' TYR . . . . . 0.628 ' HD2' ' HG2' ' A' ' 852' ' ' ARG . 13.8 m-85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.162 -0.923 . . . . 3.3900000000000001 110.916 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.421 -0.272 . . . . 9.0999999999999996 112.421 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 56.9 89.05 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.878 0.371 . . . . 8.1199999999999992 111.245 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.21 76.45 1.58 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.172 -0.467 . . . . 8.3399999999999999 110.881 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 117.84 157.34 10.61 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.813 -0.708 . . . . 4.25 112.527 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.93 -173.99 4.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.805 0.336 . . . . 2.6099999999999999 111.031 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.494 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -120.72 -176.35 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.084 -0.507 . . . . 1.22 110.811 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.99 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.4 OUTLIER -151.82 93.92 1.91 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.497 -0.557 . . . . 0.93999999999999995 109.497 179.55 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.762 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.2 OUTLIER -97.89 99.92 11.26 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.608 -0.724 . . . . 0.67000000000000004 111.233 -178.917 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.492 HD11 ' HE2' ' A' ' 801' ' ' LYS . 0.4 OUTLIER -106.28 140.9 38.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.602 -0.726 . . . . 1.5700000000000001 110.572 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.47 113.77 12.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.076 0.465 . . . . 0.81000000000000005 110.489 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.419 HG11 ' HH2' ' A' ' 834' ' ' TRP . 32.7 m -106.1 -163.92 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.516 -0.766 . . . . 1.1799999999999999 111.152 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.452 ' HG2' HG12 ' A' ' 788' ' ' VAL . 0.2 OUTLIER -150.06 169.14 21.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.219 -0.446 . . . . 1.3999999999999999 111.132 -179.89 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.33 -10.34 59.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 2.8500000000000001 110.917 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 788' ' ' VAL . . . . . 0.452 HG12 ' HG2' ' A' ' 786' ' ' GLU . 2.6 p -97.64 -28.02 3.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.921 -0.581 . . . . 0.33000000000000002 110.719 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 21.2 m0 -53.36 119.06 4.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.759 -0.655 . . . . 0.29999999999999999 111.565 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.05 168.22 16.12 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.215 -0.661 . . . . 1.8899999999999999 109.215 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -53.4 -25.51 16.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.931 0.396 . . . . 0.63 110.199 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' A' ' 796' ' ' MET . 47.1 m-20 -79.97 -57.46 3.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.952 -0.567 . . . . 2.0499999999999998 109.688 178.55 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.01 -21.72 4.82 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.036 -0.727 . . . . 1.0700000000000001 109.036 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.489 HD13 ' N ' ' A' ' 795' ' ' ILE . 1.3 tm? -75.35 -76.44 0.15 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.827 -1.079 . . . . 0.93000000000000005 110.208 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.643 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 16.3 mm -45.52 -35.67 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.162 -0.926 . . . . 0.32000000000000001 112.072 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.634 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 20.7 mtt -67.91 -48.98 64.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.563 0.22 . . . . 1.53 110.715 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -56.55 -52.81 63.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.112 0.482 . . . . 0.38 109.965 179.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.516 ' O ' HG23 ' A' ' 802' ' ' ILE . 76.4 mt -56.93 -52.71 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.553 -0.749 . . . . 0.5 110.527 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.798 ' HA ' HG12 ' A' ' 802' ' ' ILE . 1.6 t-20 -53.2 -34.29 56.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.412 -0.813 . . . . 0.81000000000000005 111.372 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 13.3 t -69.18 -30.47 68.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.337 -0.392 . . . . 0.97999999999999998 110.941 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 801' ' ' LYS . . . . . 0.492 ' HE2' HD11 ' A' ' 783' ' ' LEU . 10.1 mptt -88.38 -18.42 28.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 2.25 111.42 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.798 HG12 ' HA ' ' A' ' 799' ' ' ASN . 0.9 OUTLIER -94.8 -23.84 5.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.716 0.293 . . . . 0.75 111.355 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 803' ' ' SER . . . . . 0.42 ' N ' HG13 ' A' ' 802' ' ' ILE . 94.9 p -135.83 76.2 1.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.345 -0.389 . . . . 1.53 110.9 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -65.88 160.24 23.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 2.8300000000000001 110.772 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 5.4 t -76.75 157.18 31.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.261 -0.427 . . . . 4.2000000000000002 111.207 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 59.08 -167.6 0.16 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.034 -0.53 . . . . 7.6900000000000004 111.165 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 56.3 t30 59.04 -95.06 0.05 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.053 -0.521 . . . . 6.2199999999999998 111.059 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -130.35 94.64 3.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.779 0.323 . . . . 6.8300000000000001 110.979 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.84 89.57 1.85 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 6.4100000000000001 110.944 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 5.1 pt -84.62 165.97 2.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.137 -0.483 . . . . 4.7800000000000002 111.267 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 6.9 t -68.23 120.8 77.2 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.109 -0.496 . . . . 1.8 111.039 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 812' ' ' PRO . . . . . 0.483 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 31.2 Cg_exo -59.68 162.25 15.95 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.542 2.161 . . . . 0.94999999999999996 112.456 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.405 HG12 HD13 ' A' ' 802' ' ' ILE . 14.3 mm -115.7 153.91 17.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.123 -0.49 . . . . 1.9399999999999999 110.904 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -124.08 -68.67 0.85 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.437 -0.347 . . . . 1.1599999999999999 111.462 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.78 129.77 34.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.309 -0.405 . . . . 2.6899999999999999 110.794 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.5 pp -144.75 -178.22 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.211 -0.45 . . . . 0.83999999999999997 111.409 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.616 ' HB2' ' HB2' ' A' ' 852' ' ' ARG . 15.6 mmtt -121.79 149.92 42.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.983 -0.553 . . . . 0.84999999999999998 110.488 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 0.9 OUTLIER -130.98 165.05 24.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.364 . . . . 0.70999999999999996 111.299 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.05 109.13 21.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.947 -0.57 . . . . 1.9099999999999999 111.086 -179.252 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -79.12 167.31 21.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.566 -0.743 . . . . 1.8 110.53 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -70.06 -0.0 6.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.351 -0.386 . . . . 1.6200000000000001 111.443 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.68 13.61 33.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.446 -0.343 . . . . 1.6499999999999999 110.94 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 57.56 57.84 17.71 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.754 -0.736 . . . . 0.88 112.167 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -169.2 131.29 1.2 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 1.8600000000000001 110.708 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.496 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 57.9 m-85 -75.19 134.92 41.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.916 -0.584 . . . . 0.64000000000000001 110.974 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 826' ' ' VAL . . . . . . . . . . . . . 11.7 m -128.26 -177.91 2.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.96999999999999997 110.69 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 2.0 t -99.08 103.41 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.025 0.441 . . . . 0.56000000000000005 111.74 -179.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.478 ' HG ' ' HB3' ' A' ' 833' ' ' ASP . 8.7 tt -107.54 137.64 45.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.764 -0.653 . . . . 0.81000000000000005 110.379 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -179.76 32.92 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.269 -0.967 . . . . 0.81000000000000005 113.148 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.47 150.68 30.67 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.877 0.339 . . . . 1.3100000000000001 110.529 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -51.55 -21.93 2.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.014 0.435 . . . . 2.2000000000000002 110.386 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.52 ' O ' HG23 ' A' ' 836' ' ' VAL . 27.5 tt0 -71.6 -61.76 1.66 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.585 . . . . 2.21 110.967 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 833' ' ' ASP . . . . . 0.478 ' HB3' ' HG ' ' A' ' 828' ' ' LEU . 0.6 OUTLIER -63.45 -17.94 63.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.812 0.339 . . . . 0.72999999999999998 110.157 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.522 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.8 t-105 -82.4 -42.11 19.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.142 -0.481 . . . . 0.26000000000000001 110.425 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.753 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 16.6 m-80 -71.0 -30.87 67.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.098 0.475 . . . . 1.98 110.185 179.18 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 832' ' ' GLU . 91.2 t -75.74 -53.55 15.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.838 -0.619 . . . . 0.67000000000000004 110.011 179.274 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.84 -26.12 61.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.057 -0.519 . . . . 0.22 110.492 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.753 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 34.3 mtmt -72.46 -42.71 64.67 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.191 -0.459 . . . . 0.84999999999999998 110.32 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -64.38 -26.39 68.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.963 -0.562 . . . . 1.95 110.305 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 9.3 ttp -74.76 -39.26 61.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.791 -0.64 . . . . 0.29999999999999999 110.443 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.677 HD11 HD23 ' A' ' 849' ' ' LEU . 63.4 mt -64.49 -42.72 95.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.46999999999999997 110.845 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.0 -28.66 69.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.223 -0.444 . . . . 0.48999999999999999 111.074 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -70.61 6.94 1.23 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 1.6799999999999999 110.58 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.434 ' H ' ' C ' ' A' ' 842' ' ' ALA . 37.0 m-80 -148.1 14.76 1.03 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.042 -0.526 . . . . 1.96 110.911 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 59.19 18.22 6.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 1.99 111.14 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 846' ' ' GLU . . . . . 0.47 ' HB3' HD22 ' A' ' 841' ' ' LEU . 1.7 mm-40 -79.27 169.88 17.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.34 -0.391 . . . . 2.2999999999999998 110.936 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.8 10.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 1.98 111.195 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.762 ' HB3' HG22 ' A' ' 782' ' ' THR . 49.9 m-85 -117.23 131.68 56.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.821 0.343 . . . . 1.0900000000000001 110.629 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.677 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -110.5 123.74 50.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.73999999999999999 111.027 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -83.15 141.35 32.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.125 -0.489 . . . . 1.52 110.949 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.99 HD12 ' HB3' ' A' ' 781' ' ' PHE . 1.2 mt -133.14 151.55 34.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 116.498 -0.319 . . . . 1.04 111.821 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.616 ' HB2' ' HB2' ' A' ' 817' ' ' LYS . 0.9 OUTLIER -105.68 174.76 5.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 5.0899999999999999 110.767 179.699 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.93 40.82 3.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 2.6000000000000001 110.984 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 854' ' ' TYR . . . . . 0.468 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 2.6 p90 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.173 -0.917 . . . . 3.3900000000000001 110.995 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.16 0 N-CA-C 112.407 -0.277 . . . . 9.0999999999999996 112.407 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -91.52 -55.1 3.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.8 0.333 . . . . 8.1199999999999992 111.058 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 2.0 tpt -154.6 -177.6 6.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.199 -0.455 . . . . 8.3399999999999999 110.87 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -169.97 -108.63 0.21 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.836 -0.697 . . . . 4.25 112.495 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 55.85 70.83 0.6 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.796 0.331 . . . . 2.6099999999999999 111.07 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.27 -174.25 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 1.22 111.053 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 1.082 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -149.0 89.44 1.67 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.509 -0.552 . . . . 0.93999999999999995 109.509 179.778 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.56 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -97.53 102.2 13.9 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.911 -0.586 . . . . 0.67000000000000004 111.341 -178.889 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.54 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 8.9 mp -89.48 -176.37 5.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.544 -0.753 . . . . 1.5700000000000001 110.637 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.77 95.04 5.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.829 -0.623 . . . . 0.81000000000000005 109.523 178.541 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.59 HG11 ' CZ2' ' A' ' 834' ' ' TRP . 93.8 t -92.76 146.52 6.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.347 -0.842 . . . . 1.1799999999999999 111.683 -178.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.405 ' HB3' HG12 ' A' ' 788' ' ' VAL . 0.1 OUTLIER -102.41 171.04 7.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.817 -0.629 . . . . 1.3999999999999999 110.629 179.688 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.32 53.55 2.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 2.8500000000000001 110.858 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 788' ' ' VAL . . . . . 0.405 HG12 ' HB3' ' A' ' 786' ' ' GLU . 2.7 p -163.35 -22.97 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.981 -0.554 . . . . 0.33000000000000002 110.87 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 36.6 m0 -57.07 129.55 42.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.766 -0.652 . . . . 0.29999999999999999 112.118 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.16 166.9 11.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.707 -0.849 . . . . 1.8899999999999999 108.707 178.15 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -54.58 -23.36 16.51 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.746 -0.382 . . . . 0.63 110.076 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.594 ' O ' ' HG3' ' A' ' 796' ' ' MET . 10.0 t70 -73.24 -58.36 3.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.912 -0.585 . . . . 2.0499999999999998 109.919 178.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.39 -33.47 69.66 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 116.265 -0.425 . . . . 1.0700000000000001 110.334 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.536 HD22 ' CE2' ' A' ' 834' ' ' TRP . 24.7 tp -61.56 -51.74 67.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.832 -0.622 . . . . 0.93000000000000005 110.07 179.325 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.696 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 17.8 mm -57.76 -31.47 40.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.54 -0.755 . . . . 0.32000000000000001 111.252 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.594 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.4 mtp -67.4 -52.19 42.82 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.7 0.286 . . . . 1.53 110.504 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.5 -53.51 50.5 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.172 -0.467 . . . . 0.38 110.241 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.458 ' O ' HG23 ' A' ' 802' ' ' ILE . 70.3 mt -58.76 -50.16 80.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.772 -0.649 . . . . 0.5 110.768 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.696 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.1 t-20 -55.59 -27.91 52.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.702 -0.681 . . . . 0.81000000000000005 111.248 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 46.9 t -78.62 -26.14 45.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.354 -0.385 . . . . 0.97999999999999998 110.743 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 801' ' ' LYS . . . . . 0.502 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -97.65 -2.03 42.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 2.25 111.298 -179.824 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.729 HD13 HG12 ' A' ' 813' ' ' ILE . 1.0 OUTLIER -113.89 -34.2 2.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.733 0.301 . . . . 0.75 111.399 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 803' ' ' SER . . . . . 0.5 ' N ' HG13 ' A' ' 802' ' ' ILE . 14.7 p -124.33 -43.11 2.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 1.53 111.159 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 804' ' ' ASN . . . . . 0.435 ' HB3' ' H ' ' A' ' 805' ' ' THR . 0.2 OUTLIER 57.36 -91.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.095 -0.502 . . . . 2.8300000000000001 111.099 -179.898 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 805' ' ' THR . . . . . 0.435 ' H ' ' HB3' ' A' ' 804' ' ' ASN . 0.0 OUTLIER -102.15 153.25 20.11 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.337 -0.392 . . . . 4.2000000000000002 111.229 179.989 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -88.92 13.06 13.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 7.6900000000000004 110.888 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -102.33 31.06 4.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 6.2199999999999998 110.928 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 808' ' ' ASN . . . . . 0.425 ' HB3' HG12 ' A' ' 810' ' ' ILE . 0.9 OUTLIER -136.61 6.0 2.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.139 -0.482 . . . . 6.8300000000000001 110.941 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 59.24 56.9 3.65 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.181 -0.463 . . . . 6.4100000000000001 110.943 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 810' ' ' ILE . . . . . 0.425 HG12 ' HB3' ' A' ' 808' ' ' ASN . 12.0 mm -118.99 152.07 21.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.106 -0.497 . . . . 4.7800000000000002 110.87 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.11 120.94 39.29 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.459 . . . . 1.8 110.848 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -64.17 171.3 7.89 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.571 2.181 . . . . 0.94999999999999996 112.011 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.729 HG12 HD13 ' A' ' 802' ' ' ILE . 7.5 pt -132.86 -175.96 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 1.9399999999999999 111.148 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.84 -67.43 0.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.416 -0.357 . . . . 1.1599999999999999 111.465 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -79.58 119.36 22.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.421 -0.354 . . . . 2.6899999999999999 110.852 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 816' ' ' ILE . . . . . 0.726 ' HB ' ' HG2' ' A' ' 852' ' ' ARG . 0.2 OUTLIER -133.81 177.4 7.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.071 0.463 . . . . 0.83999999999999997 111.562 -179.591 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.757 ' H ' ' HG2' ' A' ' 852' ' ' ARG . 15.1 mmtt -115.47 166.64 11.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.668 -0.696 . . . . 0.84999999999999998 110.111 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.593 ' CE1' HG23 ' A' ' 826' ' ' VAL . 9.3 p90 -151.58 157.98 42.91 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.042 0.449 . . . . 0.70999999999999996 111.459 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 819' ' ' GLN . . . . . 0.557 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 1.6 tt0 -82.78 107.13 15.18 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.819 -0.628 . . . . 1.9099999999999999 110.733 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.415 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 12.8 t0 -78.69 178.17 8.07 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.6 -0.727 . . . . 1.8 110.67 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.28 35.49 0.33 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.412 -0.358 . . . . 1.6200000000000001 111.155 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.66 11.96 4.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 1.6499999999999999 110.608 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 823' ' ' GLY . . . . . 0.502 ' HA2' HE21 ' A' ' 819' ' ' GLN . . . 61.5 47.34 91.22 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.822 -0.704 . . . . 0.88 112.219 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -171.12 133.97 0.9 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.991 0.424 . . . . 1.8600000000000001 110.615 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.489 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 95.2 m-85 -64.12 145.21 56.32 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.891 -0.595 . . . . 0.64000000000000001 110.784 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.593 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.5 OUTLIER -132.97 177.5 7.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 0.96999999999999997 110.682 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -99.03 110.39 26.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.886 0.374 . . . . 0.56000000000000005 111.181 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.561 HD12 ' HB3' ' A' ' 833' ' ' ASP . 6.0 tp -79.93 113.84 18.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.904 -0.589 . . . . 0.81000000000000005 110.625 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -59.76 -68.88 1.47 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.934 -0.651 . . . . 0.81000000000000005 112.594 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 830' ' ' SER . . . . . 0.482 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.3 OUTLIER -171.41 -142.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.475 0.178 . . . . 1.3100000000000001 110.538 -179.834 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.482 ' H ' ' HB3' ' A' ' 830' ' ' SER . 10.3 t70 -55.18 -22.61 18.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.69 0.281 . . . . 2.2000000000000002 110.943 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 832' ' ' GLU . . . . . 0.576 ' O ' HG23 ' A' ' 836' ' ' VAL . 49.2 mt-10 -68.41 -70.85 0.24 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.383 -0.372 . . . . 2.21 110.737 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 833' ' ' ASP . . . . . 0.561 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.6 OUTLIER -60.0 -13.34 10.92 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.385 -0.37 . . . . 0.72999999999999998 110.584 179.563 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.59 ' CZ2' HG11 ' A' ' 785' ' ' VAL . 1.0 OUTLIER -79.86 -45.3 18.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.243 -0.435 . . . . 0.26000000000000001 110.014 179.172 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -67.94 -33.28 74.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.924 -0.58 . . . . 1.98 110.224 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 836' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 832' ' ' GLU . 15.7 t -73.92 -52.0 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-N 115.887 -0.597 . . . . 0.67000000000000004 109.879 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.97 -26.77 62.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.97 -0.559 . . . . 0.22 110.139 178.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.506 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 0.9 OUTLIER -67.79 -45.97 73.27 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.869 -0.605 . . . . 0.84999999999999998 110.348 179.513 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 839' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 0.0 OUTLIER -62.51 -27.76 69.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.1 -0.5 . . . . 1.95 110.225 179.486 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 10.3 ttp -72.21 -36.69 69.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.873 -0.603 . . . . 0.29999999999999999 110.419 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.685 HD11 HD23 ' A' ' 849' ' ' LEU . 3.5 mt -73.92 -47.67 36.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.84 -0.618 . . . . 0.46999999999999997 110.833 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.429 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -63.21 -24.45 67.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.065 -0.516 . . . . 0.48999999999999999 111.047 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 843' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 14.9 tt0 -65.64 -0.02 1.88 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 1.6799999999999999 110.46 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.429 ' H ' ' C ' ' A' ' 842' ' ' ALA . 9.7 m120 -145.67 17.82 1.47 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.916 -0.584 . . . . 1.96 110.681 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 4.0 m120 59.05 29.79 19.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.5 . . . . 1.99 110.887 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -84.34 156.82 21.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 2.2999999999999998 110.831 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -149.13 13.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 1.98 110.995 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.54 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 79.9 m-85 -116.46 116.19 27.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 1.0900000000000001 110.765 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.685 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -109.44 125.94 52.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.49 . . . . 0.73999999999999999 111.246 -179.615 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.557 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 9.6 m-20 -79.69 160.64 26.21 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.91 -0.587 . . . . 1.52 111.062 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 1.082 HD12 ' HB3' ' A' ' 781' ' ' PHE . 17.7 mt -132.41 161.88 40.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 116.49 -0.323 . . . . 1.04 111.628 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.757 ' HG2' ' H ' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -43.81 -81.32 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.258 -0.428 . . . . 5.0899999999999999 111.851 -179.488 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 56.85 45.46 21.51 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.007 0.432 . . . . 2.6000000000000001 110.465 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.259 -0.877 . . . . 3.3900000000000001 110.914 -179.811 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.547 -0.221 . . . . 9.0999999999999996 112.547 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 56.35 85.58 0.07 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.892 0.377 . . . . 8.1199999999999992 111.14 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 4.2 mmt -72.7 -47.3 48.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 8.3399999999999999 110.853 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 112.44 173.42 19.11 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.876 -0.678 . . . . 4.25 112.488 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 69.0 m -130.17 -69.34 0.67 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.362 . . . . 2.6099999999999999 110.907 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.494 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER -121.02 172.81 7.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.086 -0.507 . . . . 1.22 111.101 -179.904 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 0.542 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -149.06 87.02 1.52 Allowed 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.272 -0.422 . . . . 0.93999999999999995 110.194 179.803 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -98.58 109.93 22.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.872 -0.604 . . . . 0.67000000000000004 111.31 -179.416 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 783' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -115.47 -167.99 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.861 -0.609 . . . . 1.5700000000000001 110.726 179.862 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.6 104.28 10.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.956 -0.566 . . . . 0.81000000000000005 110.161 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 34.7 m -96.7 175.58 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.035 -0.53 . . . . 1.1799999999999999 111.206 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.66 162.68 26.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.066 -0.516 . . . . 1.3999999999999999 110.764 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.69 2.95 10.67 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.291 -0.413 . . . . 2.8500000000000001 110.889 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.3 p -109.71 -22.9 4.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.521 . . . . 0.33000000000000002 110.689 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -59.17 123.64 17.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.77 -0.65 . . . . 0.29999999999999999 111.902 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 790' ' ' ASN . . . . . 0.731 HD21 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -96.49 159.76 14.76 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.854 -0.795 . . . . 1.8899999999999999 108.854 178.188 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.422 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 52.0 t80 -42.68 -34.6 0.93 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.646 0.26 . . . . 0.63 111.29 -178.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.731 ' HB3' HD21 ' A' ' 790' ' ' ASN . 3.7 t0 -68.85 -55.78 10.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.835 -0.432 . . . . 2.0499999999999998 109.835 178.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 793' ' ' ASP . . . . . 0.595 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 1.0 OUTLIER -56.08 -25.4 45.29 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.218 0.532 . . . . 1.0700000000000001 109.961 179.078 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.575 HD22 ' CE2' ' A' ' 834' ' ' TRP . 37.0 tp -71.93 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.396 -0.82 . . . . 0.93000000000000005 110.241 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.658 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 42.2 mm -55.46 -28.17 22.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.565 -0.743 . . . . 0.32000000000000001 111.541 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.612 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 14.6 mtp -68.26 -50.95 50.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.652 0.263 . . . . 1.53 110.45 179.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -55.52 -53.46 56.15 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.026 0.441 . . . . 0.38 110.041 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 64.3 mt -56.75 -49.74 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.807 -0.633 . . . . 0.5 110.557 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.658 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 2.4 t30 -54.66 -28.26 45.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.7 -0.682 . . . . 0.81000000000000005 111.273 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 35.9 t -78.32 -27.1 47.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.41 -0.359 . . . . 0.97999999999999998 110.985 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -99.29 0.87 43.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 2.25 111.439 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.595 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.7 pp -117.34 -32.14 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.696 0.284 . . . . 0.75 111.397 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 64.0 p -135.99 80.63 1.84 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.922 0.391 . . . . 1.53 110.981 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -74.7 -62.75 1.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.042 -0.527 . . . . 2.8300000000000001 110.976 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.18 -72.51 0.12 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.241 -0.436 . . . . 4.2000000000000002 111.299 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -160.8 57.78 0.32 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 7.6900000000000004 110.949 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -155.88 -64.56 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.437 . . . . 6.2199999999999998 110.945 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -72.54 95.41 1.81 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 6.8300000000000001 110.812 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 61.29 177.68 0.11 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.122 -0.49 . . . . 6.4100000000000001 111.152 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 2.7 pt -140.83 156.42 22.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 4.7800000000000002 111.125 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 14.6 m 62.36 106.46 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 116.188 -0.46 . . . . 1.8 111.193 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.03 140.14 22.42 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.517 2.145 . . . . 0.94999999999999996 112.426 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.754 HD13 ' H ' ' A' ' 813' ' ' ILE . 0.2 OUTLIER -114.02 172.94 3.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 1.9399999999999999 111.079 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 31.2 p -126.85 -48.44 1.5 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 1.1599999999999999 111.158 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.5 mptt -80.69 132.05 35.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 2.6899999999999999 110.772 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 816' ' ' ILE . . . . . 0.541 HG22 ' HA ' ' A' ' 853' ' ' LEU . 1.1 pp -147.33 174.19 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.43 . . . . 0.83999999999999997 111.166 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.456 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 16.1 mmtt -120.44 145.33 47.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.038 -0.528 . . . . 0.84999999999999998 110.752 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.607 ' CE1' HG23 ' A' ' 826' ' ' VAL . 6.0 p90 -124.72 168.54 13.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.70999999999999996 110.996 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -91.38 107.76 19.42 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.042 -0.526 . . . . 1.9099999999999999 110.798 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 820' ' ' ASP . . . . . 0.41 ' HB2' HG22 ' A' ' 826' ' ' VAL . 3.9 t70 -78.73 168.87 19.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.691 -0.686 . . . . 1.8 110.641 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 821' ' ' GLU . . . . . 0.405 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.6 OUTLIER -71.48 4.24 3.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.243 -0.435 . . . . 1.6200000000000001 111.361 -179.626 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -99.88 17.0 21.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.398 -0.365 . . . . 1.6499999999999999 110.742 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 55.9 50.51 60.83 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.848 -0.691 . . . . 0.88 112.333 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -172.97 134.6 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.928 0.394 . . . . 1.8600000000000001 110.454 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.548 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 69.3 m-85 -65.76 140.01 58.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.022 -0.536 . . . . 0.64000000000000001 110.666 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.607 HG23 ' CE1' ' A' ' 818' ' ' TYR . 3.1 m -132.48 177.24 7.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 0.96999999999999997 110.589 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.67 116.17 40.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.049 0.452 . . . . 0.56000000000000005 111.447 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.55 HD12 ' HB3' ' A' ' 833' ' ' ASP . 3.7 tp -79.76 108.05 13.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.682 -0.69 . . . . 0.81000000000000005 110.631 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -53.22 -67.14 2.28 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.928 -0.653 . . . . 0.81000000000000005 112.705 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 830' ' ' SER . . . . . 0.448 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 5.7 p -170.93 -141.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.488 -0.19 . . . . 1.3100000000000001 110.488 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.448 ' H ' ' HB2' ' A' ' 830' ' ' SER . 0.9 OUTLIER -56.32 -23.82 39.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.764 0.316 . . . . 2.2000000000000002 110.874 179.788 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.17 -67.94 0.41 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.445 . . . . 2.21 110.674 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 833' ' ' ASP . . . . . 0.55 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.2 OUTLIER -63.05 -13.29 33.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.345 -0.389 . . . . 0.72999999999999998 110.318 179.492 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.575 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.6 t-105 -80.46 -40.8 25.55 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.716 -0.476 . . . . 0.26000000000000001 109.716 178.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.402 ' HA ' ' HE2' ' A' ' 838' ' ' LYS . 31.4 m-80 -76.49 -26.67 55.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.803 -0.635 . . . . 1.98 110.132 178.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -79.4 -42.76 23.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.831 -0.622 . . . . 0.67000000000000004 109.737 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.19 71.32 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.159 0.504 . . . . 0.22 109.823 178.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 0.6 OUTLIER -66.7 -48.22 69.94 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.631 -0.713 . . . . 0.84999999999999998 110.447 179.416 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -60.15 -27.63 67.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.066 -0.516 . . . . 1.95 110.512 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 840' ' ' MET . . . . . 0.405 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 8.0 ttp -72.89 -38.21 67.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.952 -0.567 . . . . 0.29999999999999999 110.487 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.875 HD11 HD23 ' A' ' 849' ' ' LEU . 7.8 mt -72.77 -18.03 61.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.46999999999999997 110.905 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.433 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.92 -29.21 44.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.48999999999999999 111.339 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.11 1.08 1.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 1.6799999999999999 110.752 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.433 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.1 OUTLIER -144.82 13.31 1.49 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 1.96 110.855 -179.965 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 58.4 18.83 5.89 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.156 -0.475 . . . . 1.99 111.065 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.25 166.66 23.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 2.2999999999999998 110.901 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.16 16.38 0.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 1.98 111.02 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.486 ' HB3' HG22 ' A' ' 782' ' ' THR . 68.6 m-85 -112.48 113.11 25.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 1.0900000000000001 110.723 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.875 HD23 HD11 ' A' ' 841' ' ' LEU . 0.2 OUTLIER -100.9 130.58 46.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.73999999999999999 110.937 -179.75 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.45 ' C ' HG12 ' A' ' 851' ' ' ILE . 3.7 m-20 -96.11 153.98 17.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.187 -0.461 . . . . 1.52 111.324 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 0.548 HG22 ' H ' ' A' ' 853' ' ' LEU . 0.8 OUTLIER -135.12 166.14 28.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.069 -0.514 . . . . 1.04 111.066 179.899 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.554 ' HB3' ' HD1' ' A' ' 854' ' ' TYR . 0.1 OUTLIER -120.25 -16.15 8.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.77 0.319 . . . . 5.0899999999999999 110.887 179.682 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 853' ' ' LEU . . . . . 0.548 ' H ' HG22 ' A' ' 851' ' ' ILE . 4.5 mm? 56.86 35.12 25.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 2.6000000000000001 111.394 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 854' ' ' TYR . . . . . 0.554 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.283 -0.865 . . . . 3.3900000000000001 110.904 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 112.459 -0.256 . . . . 9.0999999999999996 112.459 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 57.53 -161.12 0.23 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.845 0.355 . . . . 8.1199999999999992 111.163 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -82.94 89.54 6.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.147 -0.479 . . . . 8.3399999999999999 110.744 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 112.03 118.08 3.64 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.933 -0.651 . . . . 4.25 112.4 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 779' ' ' SER . . . . . 0.402 ' H ' ' H ' ' A' ' 780' ' ' ILE . 4.8 t -160.66 -16.77 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.837 0.351 . . . . 2.6099999999999999 110.713 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.402 ' H ' ' H ' ' A' ' 779' ' ' SER . 0.2 OUTLIER -138.87 175.23 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.031 -0.531 . . . . 1.22 110.881 179.971 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 781' ' ' PHE . . . . . 1.043 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.3 OUTLIER -142.09 83.65 1.85 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.665 -0.494 . . . . 0.93999999999999995 109.665 179.586 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 782' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.9 OUTLIER -98.12 123.44 42.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.743 -0.662 . . . . 0.67000000000000004 111.43 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.78 -165.54 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.693 -0.685 . . . . 1.5700000000000001 110.699 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 784' ' ' LEU . . . . . 0.415 HD12 ' HG3' ' A' ' 847' ' ' LYS . 0.4 OUTLIER -117.1 104.17 10.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.184 -0.462 . . . . 0.81000000000000005 110.271 179.499 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.531 HG21 ' HH2' ' A' ' 834' ' ' TRP . 33.8 m -97.66 -174.75 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.963 -0.562 . . . . 1.1799999999999999 111.59 -179.099 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 786' ' ' GLU . . . . . 0.423 ' HG2' HG12 ' A' ' 788' ' ' VAL . 1.1 tt0 -139.22 162.37 35.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.925 -0.58 . . . . 1.3999999999999999 110.759 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 787' ' ' LYS . . . . . 0.464 ' HA ' ' HD2' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -70.92 -7.95 49.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 2.8500000000000001 111.001 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 788' ' ' VAL . . . . . 0.423 HG12 ' HG2' ' A' ' 786' ' ' GLU . 3.0 p -100.33 -25.92 3.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.989 -0.551 . . . . 0.33000000000000002 110.955 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -56.29 121.91 10.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.955 -0.566 . . . . 0.29999999999999999 111.739 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -90.98 165.56 13.48 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.865 -0.791 . . . . 1.8899999999999999 108.865 178.226 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 791' ' ' PHE . . . . . 0.44 ' O ' HG12 ' A' ' 795' ' ' ILE . 53.3 t80 -52.04 -27.51 13.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.986 0.422 . . . . 0.63 110.089 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 792' ' ' ASP . . . . . 0.635 ' O ' ' HG3' ' A' ' 796' ' ' MET . 11.5 m-20 -69.43 -59.71 2.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.568 . . . . 2.0499999999999998 109.815 178.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.14 -32.91 62.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.149 -0.478 . . . . 1.0700000000000001 110.261 179.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.485 HD22 ' CE2' ' A' ' 834' ' ' TRP . 34.1 tp -62.41 -54.37 41.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.809 -0.632 . . . . 0.93000000000000005 110.0 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 795' ' ' ILE . . . . . 0.669 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 31.3 mm -58.02 -31.53 41.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.42 -0.809 . . . . 0.32000000000000001 111.696 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 796' ' ' MET . . . . . 0.635 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 20.3 mtt -65.94 -47.8 73.48 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.965 -0.294 . . . . 1.53 110.814 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -56.54 -55.54 32.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.104 0.478 . . . . 0.38 109.903 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 88.6 mt -55.48 -52.49 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.644 -0.707 . . . . 0.5 110.628 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 799' ' ' ASN . . . . . 0.669 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t30 -55.57 -32.14 62.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.609 -0.723 . . . . 0.81000000000000005 111.538 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.76 -19.3 57.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.887 0.375 . . . . 0.97999999999999998 110.868 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 801' ' ' LYS . . . . . 0.489 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.1 OUTLIER -106.93 -0.69 22.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.114 -0.494 . . . . 2.25 111.478 -179.907 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 802' ' ' ILE . . . . . 0.597 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.9 pp -119.49 -25.42 2.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.755 0.312 . . . . 0.75 111.511 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 93.0 p -140.37 54.64 1.62 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.972 0.415 . . . . 1.53 111.082 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -167.33 -26.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.031 -0.531 . . . . 2.8300000000000001 110.973 179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.52 -20.23 44.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 4.2000000000000002 111.083 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.53 -171.86 2.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 7.6900000000000004 110.797 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -129.7 5.43 5.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 6.2199999999999998 110.842 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -98.79 147.57 24.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.471 . . . . 6.8300000000000001 110.982 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -80.85 93.54 6.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.031 -0.531 . . . . 6.4100000000000001 110.814 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.35 -175.38 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 4.7800000000000002 111.055 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.93 122.92 36.7 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 1.8 110.777 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -61.11 -171.05 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.57 2.18 . . . . 0.94999999999999996 112.285 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 813' ' ' ILE . . . . . 0.421 HG13 HD13 ' A' ' 802' ' ' ILE . 1.2 pp -133.13 -175.78 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 1.9399999999999999 111.201 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.02 -50.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 1.1599999999999999 111.111 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -99.3 117.41 33.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.265 -0.425 . . . . 2.6899999999999999 110.909 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 816' ' ' ILE . . . . . 0.598 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -135.62 178.9 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.109 -0.496 . . . . 0.83999999999999997 111.28 -179.917 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.805 ' H ' ' HG2' ' A' ' 852' ' ' ARG . 19.5 mttt -117.92 163.71 16.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.955 -0.566 . . . . 0.84999999999999998 110.295 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 818' ' ' TYR . . . . . 0.652 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 20.1 p90 -132.93 158.6 42.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.881 0.372 . . . . 0.70999999999999996 111.145 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 819' ' ' GLN . . . . . 0.727 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -96.2 108.02 20.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.18 0.514 . . . . 1.9099999999999999 110.327 179.811 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -79.33 174.82 11.18 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.564 -0.744 . . . . 1.8 110.882 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 821' ' ' GLU . . . . . 0.411 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.1 OUTLIER -81.8 40.28 0.59 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.101 -0.5 . . . . 1.6200000000000001 111.116 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -140.11 11.76 2.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 1.6499999999999999 110.618 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 61.69 56.23 24.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.83 -0.7 . . . . 0.88 112.338 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -169.99 132.96 1.14 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.956 0.408 . . . . 1.8600000000000001 110.82 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 825' ' ' PHE . . . . . 0.48 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 77.0 m-85 -77.43 129.04 35.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.886 -0.597 . . . . 0.64000000000000001 110.958 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 826' ' ' VAL . . . . . 0.652 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 0.9 OUTLIER -107.65 167.69 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 116.106 -0.497 . . . . 0.96999999999999997 111.057 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 827' ' ' VAL . . . . . 0.715 HG13 ' HE2' ' A' ' 817' ' ' LYS . 0.2 OUTLIER -99.67 104.48 16.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.267 -0.424 . . . . 0.56000000000000005 111.055 179.856 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 2.2 tt -80.21 125.64 30.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.035 -0.53 . . . . 0.81000000000000005 110.782 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -81.31 -56.59 2.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.784 -0.722 . . . . 0.81000000000000005 112.775 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 50.6 p -171.28 -141.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.415 -0.217 . . . . 1.3100000000000001 110.415 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 10.4 p-10 -57.58 -15.43 7.34 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.648 0.261 . . . . 2.2000000000000002 110.908 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -68.48 -76.32 0.09 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.313 -0.403 . . . . 2.21 110.699 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -11.49 17.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.34 -0.391 . . . . 0.72999999999999998 110.365 179.541 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 834' ' ' TRP . . . . . 0.531 ' HH2' HG21 ' A' ' 785' ' ' VAL . 1.4 t-105 -79.95 -38.53 32.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.138 0.494 . . . . 0.26000000000000001 109.931 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 835' ' ' ASN . . . . . 0.701 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -76.14 -34.28 59.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.768 -0.651 . . . . 1.98 110.005 179.018 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -72.18 -43.93 65.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.484 -0.78 . . . . 0.67000000000000004 109.861 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -69.0 -25.25 64.42 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.207 -0.451 . . . . 0.22 110.115 178.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 838' ' ' LYS . . . . . 0.701 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 30.3 mtmt -72.91 -40.9 65.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.958 -0.565 . . . . 0.84999999999999998 110.066 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 -64.68 -31.48 72.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.97 -0.559 . . . . 1.95 110.039 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 840' ' ' MET . . . . . 0.411 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 10.2 ttp -67.81 -38.96 83.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.829 -0.623 . . . . 0.29999999999999999 110.14 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 841' ' ' LEU . . . . . 0.965 HD11 HD23 ' A' ' 849' ' ' LEU . 47.1 mt -69.61 -37.68 76.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.82 -0.627 . . . . 0.46999999999999997 110.725 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 842' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -67.8 -29.69 68.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.48999999999999999 111.083 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -67.31 1.89 1.95 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.114 -0.493 . . . . 1.6799999999999999 110.614 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 844' ' ' ASN . . . . . 0.406 ' H ' ' C ' ' A' ' 842' ' ' ALA . 13.6 m120 -142.76 17.18 1.98 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 1.96 110.928 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 4.8 m120 59.51 15.87 4.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.177 -0.465 . . . . 1.99 111.041 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -79.75 166.25 21.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 2.2999999999999998 110.85 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 847' ' ' LYS . . . . . 0.415 ' HG3' HD12 ' A' ' 784' ' ' LEU . 0.0 OUTLIER -157.01 12.46 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 1.98 110.949 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 848' ' ' PHE . . . . . 0.411 ' HB3' ' CG2' ' A' ' 782' ' ' THR . 5.2 m-85 -108.3 127.63 54.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 1.0900000000000001 110.973 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 849' ' ' LEU . . . . . 0.965 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -118.28 128.98 55.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.151 -0.477 . . . . 0.73999999999999999 110.973 -179.798 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 850' ' ' ASN . . . . . 0.727 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 2.6 m-80 -89.22 167.32 13.19 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.948 -0.569 . . . . 1.52 111.313 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 851' ' ' ILE . . . . . 1.043 HD12 ' HB3' ' A' ' 781' ' ' PHE . 53.3 mt -130.75 160.19 42.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.404 -0.362 . . . . 1.04 111.314 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 852' ' ' ARG . . . . . 0.805 ' HG2' ' H ' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -45.96 -92.36 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.274 -0.421 . . . . 5.0899999999999999 111.732 -179.52 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 53.59 29.31 9.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.55 -0.296 . . . . 2.6000000000000001 111.256 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 2.8 p90 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.268 -0.872 . . . . 3.3900000000000001 110.993 179.869 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.507 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 1.1 mt . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.742 0.306 . . . . 1.22 110.927 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.759 ' HB2' ' HB ' ' A' ' 851' ' ' ILE . 0.7 OUTLIER -143.39 84.72 1.82 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.268 -0.423 . . . . 0.93999999999999995 110.366 179.735 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.624 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.2 OUTLIER -98.0 103.28 15.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.905 -0.589 . . . . 0.67000000000000004 110.6 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.717 HD22 ' HE2' ' A' ' 801' ' ' LYS . 0.1 OUTLIER -112.56 -166.44 1.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.626 -0.715 . . . . 1.5700000000000001 110.732 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.79 112.06 19.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.056 -0.52 . . . . 0.81000000000000005 110.035 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 10.1 m -103.67 157.1 5.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.998 -0.546 . . . . 1.1799999999999999 111.138 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.548 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 4.1 tp10 -102.8 170.45 7.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 1.3999999999999999 110.978 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . 0.548 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.4 OUTLIER -83.65 27.04 0.64 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 2.8500000000000001 110.6 179.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -136.58 -25.44 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.932 -0.576 . . . . 0.33000000000000002 110.57 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -52.6 123.15 10.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.702 -0.681 . . . . 0.29999999999999999 111.939 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.98 166.03 12.9 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.733 -0.84 . . . . 1.8899999999999999 108.733 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.495 ' O ' HG12 ' A' ' 795' ' ' ILE . 93.0 t80 -52.71 -28.46 22.05 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.693 -0.403 . . . . 0.63 110.165 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.515 ' O ' ' HG3' ' A' ' 796' ' ' MET . 14.6 t70 -68.75 -56.24 8.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.07 -0.514 . . . . 2.0499999999999998 109.702 178.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . 0.459 ' HA ' ' HG3' ' A' ' 796' ' ' MET . 1.2 t0 -57.44 -33.05 67.52 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.969 -0.56 . . . . 1.0700000000000001 110.232 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.51 HD22 ' CE2' ' A' ' 834' ' ' TRP . 30.5 tp -63.69 -53.16 55.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.864 -0.607 . . . . 0.93000000000000005 109.91 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.66 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 35.8 mm -56.62 -27.01 24.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.645 -0.707 . . . . 0.32000000000000001 111.23 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.515 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 10.5 mtp -67.66 -46.95 70.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.724 0.297 . . . . 1.53 110.458 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . 0.439 ' O ' ' HD3' ' A' ' 801' ' ' LYS . . . -56.87 -53.68 55.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.037 0.446 . . . . 0.38 109.935 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.529 HD11 HD12 ' A' ' 851' ' ' ILE . 75.4 mt -57.95 -51.44 70.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.746 -0.661 . . . . 0.5 110.616 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.66 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t-20 -56.27 -26.96 53.65 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.519 -0.764 . . . . 0.81000000000000005 111.325 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.11 -23.47 41.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.317 -0.401 . . . . 0.97999999999999998 110.614 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . 0.717 ' HE2' HD22 ' A' ' 783' ' ' LEU . 0.5 OUTLIER -101.08 -1.67 33.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.952 -0.567 . . . . 2.25 111.179 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.673 HD13 HG12 ' A' ' 813' ' ' ILE . 1.4 pp -117.14 -29.42 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.453 -0.34 . . . . 0.75 111.349 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . 0.515 ' HB2' HD12 ' A' ' 802' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.283 -0.417 . . . . 1.53 110.871 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 C--O 1.232 0.202 0 CA-C-O 120.772 0.239 . . . . 0.94999999999999996 112.486 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.673 HG12 HD13 ' A' ' 802' ' ' ILE . 4.4 pt -145.05 171.87 5.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.122 -0.49 . . . . 1.9399999999999999 110.931 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 3.2 p -144.57 -53.81 0.32 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.319 -0.401 . . . . 1.1599999999999999 111.271 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -81.98 114.92 20.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 2.6899999999999999 110.767 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . 0.595 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -136.08 169.27 20.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.232 -0.44 . . . . 0.83999999999999997 111.318 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 8.9 mttt -110.58 166.68 10.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.025 -0.534 . . . . 0.84999999999999998 110.421 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.571 ' CE1' HG23 ' A' ' 826' ' ' VAL . 10.6 p90 -149.77 152.94 36.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.973 0.416 . . . . 0.70999999999999996 111.377 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . 0.41 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -76.74 108.01 9.45 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.933 -0.576 . . . . 1.9099999999999999 110.672 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.544 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.0 t70 -78.97 179.3 7.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.383 -0.826 . . . . 1.8 110.792 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.71 35.96 0.53 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 1.6200000000000001 111.051 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.33 16.27 3.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.32 -0.4 . . . . 1.6499999999999999 110.999 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 60.98 46.45 94.55 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.787 -0.721 . . . . 0.88 112.319 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -174.02 134.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.972 0.415 . . . . 1.8600000000000001 110.65 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.421 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 72.5 m-85 -65.7 144.97 56.58 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.944 -0.571 . . . . 0.64000000000000001 110.766 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.571 HG23 ' CE1' ' A' ' 818' ' ' TYR . 1.0 OUTLIER -130.03 179.56 4.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.96999999999999997 110.903 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.7 113.57 33.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.981 0.42 . . . . 0.56000000000000005 111.397 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.97 131.5 34.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.804 -0.634 . . . . 0.81000000000000005 110.725 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -76.76 -68.52 1.51 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.723 -0.751 . . . . 0.81000000000000005 112.669 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 90.7 p -170.17 -137.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.38 -0.23 . . . . 1.3100000000000001 110.38 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -54.45 -27.93 40.81 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.907 0.384 . . . . 2.2000000000000002 110.65 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.544 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.9 OUTLIER -63.92 -68.41 0.35 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.08 -0.509 . . . . 2.21 110.882 179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -11.28 28.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.3 -0.409 . . . . 0.72999999999999998 110.674 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.516 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.5 t-105 -82.86 -41.65 18.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.26000000000000001 110.176 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 54.9 m-20 -73.42 -27.33 61.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.048 -0.524 . . . . 1.98 110.001 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 832' ' ' GLU . 51.0 t -78.84 -51.42 17.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.771 -0.65 . . . . 0.67000000000000004 109.928 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.45 66.34 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.991 -0.55 . . . . 0.22 110.314 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.428 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 1.7 mtpp -67.16 -49.34 65.09 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.877 -0.602 . . . . 0.84999999999999998 110.467 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.88 -24.77 66.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 1.95 110.334 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.9 ttp -75.56 -34.05 60.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.84 -0.618 . . . . 0.29999999999999999 110.37 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.805 HD11 HD23 ' A' ' 849' ' ' LEU . 27.8 mt -69.98 -47.42 62.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.915 -0.584 . . . . 0.46999999999999997 110.803 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.53 -3.64 44.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.48999999999999999 111.404 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -3.49 2.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.971 0.415 . . . . 1.6799999999999999 110.171 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.416 ' H ' ' C ' ' A' ' 842' ' ' ALA . 1.5 m120 -145.35 -73.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.771 -0.649 . . . . 1.96 110.322 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -179.26 27.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.833 -0.622 . . . . 1.99 110.921 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.22 142.96 30.98 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.291 -0.413 . . . . 2.2999999999999998 110.913 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -132.91 -16.65 2.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.947 -0.569 . . . . 1.98 110.698 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.624 ' HB3' HG22 ' A' ' 782' ' ' THR . 32.7 m-85 -84.46 144.9 28.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.171 -0.468 . . . . 1.0900000000000001 111.133 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.805 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -124.42 131.19 53.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.935 -0.575 . . . . 0.73999999999999999 110.516 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.446 ' C ' HG12 ' A' ' 851' ' ' ILE . 10.5 m120 -89.87 153.58 20.53 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.885 -0.598 . . . . 1.52 111.185 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.759 ' HB ' ' HB2' ' A' ' 781' ' ' PHE . 1.5 mm . . . . . 0 C--N 1.333 -0.15 0 CA-C-N 116.123 -0.49 . . . . 1.04 111.413 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.756 0.312 . . . . 1.22 110.949 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 1.001 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.3 OUTLIER -153.77 92.05 1.52 Allowed 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.053 0.454 . . . . 0.93999999999999995 110.006 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.561 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -97.43 97.93 9.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.736 -0.666 . . . . 0.67000000000000004 110.89 -179.349 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.5 OUTLIER -91.56 146.73 23.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.595 -0.73 . . . . 1.5700000000000001 111.086 -179.671 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.78 108.98 12.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.404 . . . . 0.81000000000000005 110.555 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 847' ' ' LYS . 17.3 m -98.48 -166.6 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.898 -0.592 . . . . 1.1799999999999999 111.371 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.582 ' HG2' HG12 ' A' ' 788' ' ' VAL . 0.8 OUTLIER -140.37 171.55 13.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.278 -0.419 . . . . 1.3999999999999999 111.003 -179.856 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.03 20.15 2.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 2.8500000000000001 110.853 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . 0.582 HG12 ' HG2' ' A' ' 786' ' ' GLU . 1.7 p -136.18 -26.33 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.777 -0.647 . . . . 0.33000000000000002 110.72 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 24.5 m0 -51.92 126.63 18.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.935 -0.575 . . . . 0.29999999999999999 111.848 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . 0.484 HD22 ' H ' ' A' ' 793' ' ' ASP . 0.0 OUTLIER -93.11 168.67 10.96 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.051 -0.722 . . . . 1.8899999999999999 109.051 178.313 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.407 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 69.8 t80 -54.4 -24.75 21.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.011 0.434 . . . . 0.63 110.06 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.654 ' O ' ' HG3' ' A' ' 796' ' ' MET . 26.3 t0 -73.19 -61.78 1.7 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.803 -0.635 . . . . 2.0499999999999998 109.851 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . 0.484 ' H ' HD22 ' A' ' 790' ' ' ASN . 3.0 m-20 -54.01 -27.35 31.31 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.159 -0.473 . . . . 1.0700000000000001 110.045 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.576 HD22 ' CE2' ' A' ' 834' ' ' TRP . 32.1 tp -68.55 -58.12 4.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.783 -0.644 . . . . 0.93000000000000005 110.403 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.7 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 19.9 mm -56.86 -32.24 38.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.521 -0.763 . . . . 0.32000000000000001 111.647 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.654 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.5 mtt -66.81 -52.87 38.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.7 0.286 . . . . 1.53 110.601 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.89 -54.94 31.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.022 0.439 . . . . 0.38 110.192 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 46.6 mt -56.26 -48.77 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.763 -0.653 . . . . 0.5 110.52 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.7 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.2 t-20 -57.96 -23.84 55.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.871 -0.604 . . . . 0.81000000000000005 111.099 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.81 -24.21 38.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.031 0.444 . . . . 0.97999999999999998 110.316 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . 0.519 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -101.85 -2.34 30.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.766 -0.652 . . . . 2.25 111.297 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.57 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.8 pp -121.2 -25.11 2.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.79 0.328 . . . . 0.75 111.414 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 44.1 t . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.285 -0.416 . . . . 1.53 110.825 -179.905 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo . . . . . 0 N--CA 1.47 0.14 0 CA-C-O 120.819 0.258 . . . . 0.94999999999999996 112.269 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 42.2 pt -136.22 154.68 33.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.9 0.381 . . . . 1.9399999999999999 111.436 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 9.8 p -133.44 -64.23 0.73 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.969 -0.559 . . . . 1.1599999999999999 110.824 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.44 123.38 32.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.486 . . . . 2.6899999999999999 110.31 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.7 pp -144.65 174.14 3.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.066 0.46 . . . . 0.83999999999999997 111.89 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -105.54 172.94 6.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.649 -0.705 . . . . 0.84999999999999998 110.32 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.576 ' CE1' HG23 ' A' ' 826' ' ' VAL . 9.0 p90 -158.03 163.01 38.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.932 0.396 . . . . 0.70999999999999996 111.421 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . 0.491 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 0.4 OUTLIER -82.32 107.59 15.11 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.902 -0.59 . . . . 1.9099999999999999 110.713 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.446 ' HB3' HG22 ' A' ' 826' ' ' VAL . 0.2 OUTLIER -79.02 -178.76 6.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.479 -0.782 . . . . 1.8 110.795 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -82.86 38.61 0.59 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.294 -0.412 . . . . 1.6200000000000001 111.284 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -140.16 9.1 2.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.34 -0.391 . . . . 1.6499999999999999 110.848 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . 0.41 ' HA2' ' NE2' ' A' ' 819' ' ' GLN . . . 65.1 49.08 63.96 Favored Glycine 0 C--N 1.331 0.258 0 C-N-CA 120.682 -0.771 . . . . 0.88 112.287 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -169.29 134.3 1.5 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.982 0.42 . . . . 1.8600000000000001 110.617 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.511 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 94.5 m-85 -63.69 136.03 57.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.881 -0.599 . . . . 0.64000000000000001 110.871 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.576 HG23 ' CE1' ' A' ' 818' ' ' TYR . 3.0 m -126.46 179.15 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 0.96999999999999997 110.595 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.93 114.53 36.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.954 0.407 . . . . 0.56000000000000005 111.537 -179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 4.8 tp -83.17 122.44 28.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.809 -0.632 . . . . 0.81000000000000005 110.86 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.29 -75.36 0.48 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.783 -0.722 . . . . 0.81000000000000005 112.619 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -161.75 -141.97 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 110.499 -0.186 . . . . 1.3100000000000001 110.499 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -59.41 -16.39 22.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.729 0.3 . . . . 2.2000000000000002 110.84 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.553 ' O ' HG23 ' A' ' 836' ' ' VAL . 29.1 mt-10 -75.05 -66.32 0.77 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.235 -0.439 . . . . 2.21 110.613 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -61.59 -15.15 36.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.285 -0.416 . . . . 0.72999999999999998 110.263 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.576 ' CE2' HD22 ' A' ' 794' ' ' LEU . 2.8 t-105 -82.37 -39.27 22.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.26000000000000001 109.59 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.721 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -69.61 -37.74 76.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.86 -0.609 . . . . 1.98 109.751 178.776 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 832' ' ' GLU . 24.3 t -69.88 -54.65 18.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.557 -0.747 . . . . 0.67000000000000004 109.675 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.97 -24.72 40.14 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.855 -0.612 . . . . 0.22 110.324 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.721 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 27.8 mtmt -71.88 -45.49 61.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.835 -0.62 . . . . 0.84999999999999998 110.317 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -65.22 -17.64 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.835 -0.621 . . . . 1.95 110.349 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 6.2 ttp -83.46 -33.85 25.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.683 -0.69 . . . . 0.29999999999999999 110.403 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.911 HD11 HD23 ' A' ' 849' ' ' LEU . 20.5 mt -68.84 -45.79 70.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.46999999999999997 110.898 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -64.88 -28.14 69.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.48999999999999999 111.407 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.81 8.26 0.93 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.227 -0.442 . . . . 1.6799999999999999 110.74 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.434 ' H ' ' C ' ' A' ' 842' ' ' ALA . 11.2 m-80 -146.53 16.56 1.29 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.018 -0.537 . . . . 1.96 110.802 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 59.93 19.6 8.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.051 -0.522 . . . . 1.99 111.128 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . 0.438 ' HB3' HD22 ' A' ' 841' ' ' LEU . 3.2 mt-10 -83.5 170.85 13.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.422 -0.354 . . . . 2.2999999999999998 110.654 179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . 0.487 ' O ' HG22 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -152.07 -30.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.425 -0.352 . . . . 1.98 111.273 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.462 ' HB3' ' HB ' ' A' ' 782' ' ' THR . 4.1 m-85 -82.4 143.09 31.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.918 0.39 . . . . 1.0900000000000001 111.041 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.911 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -122.29 121.33 36.5 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.04 -0.527 . . . . 0.73999999999999999 110.744 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.491 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 4.6 m-20 -75.45 161.65 29.03 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.993 -0.549 . . . . 1.52 111.327 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 1.001 HD12 ' HB3' ' A' ' 781' ' ' PHE . 6.0 mt . . . . . 0 C--N 1.334 -0.104 0 CA-C-N 116.184 -0.462 . . . . 1.04 111.025 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.496 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.711 0.291 . . . . 1.22 110.855 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.659 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.37 97.45 1.23 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.985 0.422 . . . . 0.93999999999999995 109.911 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.526 HG23 ' OD1' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -96.86 94.14 7.07 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.297 0.57 . . . . 0.67000000000000004 110.765 -179.438 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.445 ' HA ' HD22 ' A' ' 783' ' ' LEU . 0.2 OUTLIER -92.16 114.65 27.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.42 -0.809 . . . . 1.5700000000000001 111.036 -179.489 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.486 HD12 ' HE1' ' A' ' 848' ' ' PHE . 6.8 tt -62.12 103.99 0.43 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.072 -0.513 . . . . 0.81000000000000005 110.535 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.445 HG21 ' HH2' ' A' ' 834' ' ' TRP . 26.3 m -98.4 -172.0 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.979 -0.555 . . . . 1.1799999999999999 111.413 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.43 176.27 8.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.138 -0.483 . . . . 1.3999999999999999 110.882 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.98 35.46 0.79 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.097 0.475 . . . . 2.8500000000000001 110.806 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.0 p -150.77 -28.38 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.674 -0.694 . . . . 0.33000000000000002 110.896 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 23.3 m0 -49.06 124.24 8.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.826 -0.624 . . . . 0.29999999999999999 111.736 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.66 166.66 12.68 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.142 -0.688 . . . . 1.8899999999999999 109.142 178.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.433 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 77.2 t80 -52.83 -24.1 8.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.944 0.402 . . . . 0.63 110.172 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.656 ' O ' ' HG3' ' A' ' 796' ' ' MET . 2.1 t70 -72.25 -62.49 1.42 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.868 -0.605 . . . . 2.0499999999999998 109.697 178.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -53.63 -27.02 24.71 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 116.158 -0.474 . . . . 1.0700000000000001 110.356 179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.627 HD22 ' CE2' ' A' ' 834' ' ' TRP . 26.9 tp -70.19 -54.34 13.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.858 -0.61 . . . . 0.93000000000000005 110.478 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.687 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 23.5 mm -59.23 -34.1 52.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.654 -0.703 . . . . 0.32000000000000001 111.868 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.656 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 21.8 mtm -71.17 -43.4 67.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.636 0.255 . . . . 1.53 111.067 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.95 79.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.272 0.558 . . . . 0.38 109.975 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.474 ' O ' HG23 ' A' ' 802' ' ' ILE . 48.1 mt -62.94 -47.8 91.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.446 -0.797 . . . . 0.5 110.281 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.742 ' HA ' HG12 ' A' ' 802' ' ' ILE . 0.8 OUTLIER -56.13 -29.58 60.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.846 -0.616 . . . . 0.81000000000000005 111.133 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.84 -29.49 58.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.97999999999999998 110.848 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . 0.539 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -94.41 -3.93 49.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 2.25 111.467 -179.77 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.742 HG12 ' HA ' ' A' ' 799' ' ' ASN . 7.0 pt -113.76 -22.15 5.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.761 0.315 . . . . 0.75 111.244 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.258 -0.428 . . . . 1.53 111.006 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.833 0.264 . . . . 0.94999999999999996 112.484 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 4.4 mm -107.61 148.7 11.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 1.9399999999999999 111.092 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 82.1 p -115.94 -47.2 2.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.25 -0.432 . . . . 1.1599999999999999 111.374 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.94 139.18 30.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.266 -0.425 . . . . 2.6899999999999999 111.093 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -150.63 168.77 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.126 -0.488 . . . . 0.83999999999999997 111.169 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.638 ' HE2' HG13 ' A' ' 827' ' ' VAL . 14.6 mmtt -115.45 134.63 54.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 0.84999999999999998 110.646 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.602 ' CE1' HG23 ' A' ' 826' ' ' VAL . 5.4 p90 -113.33 168.48 9.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.893 0.378 . . . . 0.70999999999999996 111.26 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -93.68 105.99 17.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.975 -0.557 . . . . 1.9099999999999999 110.761 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.456 ' HB2' HG22 ' A' ' 826' ' ' VAL . 4.6 t0 -79.07 169.65 17.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.83 -0.623 . . . . 1.8 110.373 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.9 52.65 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.189 0.518 . . . . 1.6200000000000001 111.105 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 -141.05 1.5 1.65 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.679 -0.691 . . . . 1.6499999999999999 110.463 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 74.6 44.44 26.39 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.882 -0.675 . . . . 0.88 111.982 -179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -174.08 142.44 0.84 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 121.164 0.507 . . . . 1.8600000000000001 110.57 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.438 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 70.6 m-85 -72.25 147.26 46.64 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.625 -0.716 . . . . 0.64000000000000001 110.462 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.602 HG23 ' CE1' ' A' ' 818' ' ' TYR . 2.4 m -137.48 177.92 5.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.305 -0.407 . . . . 0.96999999999999997 110.726 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . 0.638 HG13 ' HE2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -98.93 118.65 45.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.019 0.438 . . . . 0.56000000000000005 111.35 -179.626 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.457 HD12 ' HB3' ' A' ' 833' ' ' ASP . 3.5 tp -79.75 113.67 18.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.767 -0.651 . . . . 0.81000000000000005 110.745 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -58.01 -71.75 0.7 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.995 -0.621 . . . . 0.81000000000000005 112.751 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 57.4 p -171.07 -136.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.502 0.191 . . . . 1.3100000000000001 110.732 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.459 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 0.7 OUTLIER -57.85 -20.59 37.44 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.771 0.32 . . . . 2.2000000000000002 110.967 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.487 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.5 OUTLIER -72.62 -68.29 0.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.428 . . . . 2.21 110.947 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . 0.457 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.6 OUTLIER -60.9 -13.35 15.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.72999999999999998 110.793 179.776 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.627 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.5 t-105 -86.26 -40.38 15.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.9 0.381 . . . . 0.26000000000000001 110.111 179.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.743 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -68.91 -37.09 78.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.95 -0.568 . . . . 1.98 109.885 179.064 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 832' ' ' GLU . 39.9 t -72.25 -54.47 16.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.462 -0.79 . . . . 0.67000000000000004 110.149 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.01 -25.48 61.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.0 -0.545 . . . . 0.22 110.601 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.743 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 23.8 mtmt -69.73 -42.67 73.66 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.169 -0.469 . . . . 0.84999999999999998 110.191 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 5.0 mt-10 -68.11 -25.93 65.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.061 -0.518 . . . . 1.95 110.161 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 12.4 ttp -74.97 -35.72 62.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.746 -0.661 . . . . 0.29999999999999999 110.497 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.646 HD11 HD23 ' A' ' 849' ' ' LEU . 15.4 mt -67.69 -49.21 63.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.46999999999999997 110.917 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . . . . . . . . . . . -80.46 -0.34 36.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.48999999999999999 111.544 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 0.5 OUTLIER -66.43 -0.86 2.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.998 0.428 . . . . 1.6799999999999999 110.377 179.466 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -149.74 -71.2 0.19 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.847 -0.615 . . . . 1.96 110.63 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -177.82 26.33 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.959 -0.564 . . . . 1.99 111.162 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -100.62 140.93 34.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.824 0.345 . . . . 2.2999999999999998 110.876 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.3 2.84 2.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 1.98 110.931 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.486 ' HE1' HD12 ' A' ' 784' ' ' LEU . 0.5 OUTLIER -111.02 126.03 54.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.358 -0.383 . . . . 1.0900000000000001 110.947 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.646 HD23 HD11 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -97.37 133.32 42.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.083 -0.508 . . . . 0.73999999999999999 110.697 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.526 ' OD1' HG23 ' A' ' 782' ' ' THR . 6.5 m-20 -85.59 153.93 22.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 1.52 111.197 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.659 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.4 mm . . . . . 0 C--N 1.332 -0.161 0 CA-C-N 116.202 -0.454 . . . . 1.04 111.096 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.45 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.074 0 CA-C-O 120.676 0.274 . . . . 1.22 110.719 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.706 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -133.59 78.44 1.77 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.112 0.482 . . . . 0.93999999999999995 110.113 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.1 OUTLIER -98.46 115.7 29.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.67000000000000004 111.378 -179.401 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.51 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -116.9 -167.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.709 -0.678 . . . . 1.5700000000000001 110.672 179.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -116.34 110.92 19.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.028 -0.533 . . . . 0.81000000000000005 110.372 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.639 HG21 ' HH2' ' A' ' 834' ' ' TRP . 28.8 m -107.45 158.57 7.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 1.1799999999999999 111.539 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.618 ' HG2' HG12 ' A' ' 788' ' ' VAL . 1.1 tt0 -110.18 171.06 7.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.983 -0.553 . . . . 1.3999999999999999 110.725 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -79.19 -9.36 59.54 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.039 0.447 . . . . 2.8500000000000001 110.783 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . 0.618 HG12 ' HG2' ' A' ' 786' ' ' GLU . 2.7 p -96.06 -24.26 4.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.785 -0.643 . . . . 0.33000000000000002 110.848 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -56.73 126.17 25.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.29999999999999999 111.931 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.85 167.94 10.79 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.009 -0.737 . . . . 1.8899999999999999 109.009 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.442 ' O ' HG12 ' A' ' 795' ' ' ILE . 80.6 t80 -54.67 -24.3 21.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.885 0.374 . . . . 0.63 110.069 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 796' ' ' MET . 24.1 m-20 -73.58 -57.6 3.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.979 -0.555 . . . . 2.0499999999999998 109.758 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.31 -30.5 64.8 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.166 -0.47 . . . . 1.0700000000000001 110.124 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.531 HD13 ' CZ2' ' A' ' 834' ' ' TRP . 30.2 tp -65.46 -54.72 24.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.712 -0.676 . . . . 0.93000000000000005 110.281 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.656 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 30.3 mm -57.25 -27.98 29.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.484 -0.78 . . . . 0.32000000000000001 111.535 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.5 mtt -68.18 -51.01 50.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.716 0.294 . . . . 1.53 110.548 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.04 -53.06 58.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.057 0.456 . . . . 0.38 109.911 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.469 HG21 HD11 ' A' ' 813' ' ' ILE . 74.2 mt -57.49 -53.02 49.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.643 -0.708 . . . . 0.5 110.428 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.656 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.7 OUTLIER -54.96 -24.64 24.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.563 -0.744 . . . . 0.81000000000000005 111.283 -179.852 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 42.1 t -78.79 -27.56 44.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.349 -0.387 . . . . 0.97999999999999998 110.537 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.41 4.6 36.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.985 -0.552 . . . . 2.25 111.358 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.568 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.0 OUTLIER -127.22 -23.63 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 111.933 0.346 . . . . 0.75 111.933 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 C--N 1.33 -0.24 0 CA-C-O 120.729 0.299 . . . . 1.53 111.078 -179.717 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo . . . . . 0 C--O 1.231 0.148 0 CA-C-O 120.728 0.22 . . . . 0.94999999999999996 112.105 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.544 HG12 HD13 ' A' ' 802' ' ' ILE . 8.7 pt -140.93 -176.25 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.959 0.409 . . . . 1.9399999999999999 111.294 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 1.6 t -158.57 -40.42 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.97 -0.559 . . . . 1.1599999999999999 110.981 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.79 126.92 52.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.081 -0.509 . . . . 2.6899999999999999 110.821 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -155.27 -176.17 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 0.83999999999999997 111.365 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 851' ' ' ILE . 17.5 mmtt -108.64 169.67 8.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.84999999999999998 110.595 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.506 ' CE1' HG23 ' A' ' 826' ' ' VAL . 11.0 p90 -157.29 157.25 33.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.988 0.423 . . . . 0.70999999999999996 111.191 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . 0.513 ' HA ' ' O ' ' A' ' 824' ' ' ASP . 55.3 tt0 -76.33 102.15 5.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.897 -0.592 . . . . 1.9099999999999999 111.039 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.5 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.2 t0 -79.24 -176.01 4.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.587 -0.733 . . . . 1.8 110.627 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -81.79 15.13 2.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.362 -0.381 . . . . 1.6200000000000001 111.185 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.34 6.11 44.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.432 . . . . 1.6499999999999999 111.07 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 75.2 16.35 80.65 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.736 . . . . 0.88 112.482 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . 0.513 ' O ' ' HA ' ' A' ' 819' ' ' GLN . 2.8 t0 -143.49 -147.35 0.21 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.754 0.311 . . . . 1.8600000000000001 110.358 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.412 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 49.3 m-85 -129.02 150.89 50.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.295 -0.411 . . . . 0.64000000000000001 110.895 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.506 HG23 ' CE1' ' A' ' 818' ' ' TYR . 8.4 m -139.14 -178.58 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.96999999999999997 110.558 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -98.64 113.41 33.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.969 0.414 . . . . 0.56000000000000005 111.682 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -80.36 120.27 24.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.909 -0.587 . . . . 0.81000000000000005 110.63 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -68.48 -72.5 0.81 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.847 -0.692 . . . . 0.81000000000000005 112.621 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.79 -136.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.492 0.187 . . . . 1.3100000000000001 110.51 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -59.61 -16.26 24.52 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.702 0.287 . . . . 2.2000000000000002 110.822 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.532 ' O ' HG23 ' A' ' 836' ' ' VAL . 32.0 mt-10 -74.89 -70.4 0.41 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.284 -0.417 . . . . 2.21 110.827 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -61.77 -11.76 13.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.72999999999999998 110.841 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.639 ' HH2' HG21 ' A' ' 785' ' ' VAL . 2.0 t-105 -84.01 -40.7 18.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.891 0.377 . . . . 0.26000000000000001 110.17 179.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.719 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -69.07 -35.22 76.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 1.98 110.024 179.112 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 832' ' ' GLU . 13.2 t -74.71 -53.56 16.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.67000000000000004 110.132 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -56.57 -27.16 57.22 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.124 -0.489 . . . . 0.22 110.488 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.719 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 21.4 mtmt -68.55 -47.89 65.71 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.988 -0.551 . . . . 0.84999999999999998 110.336 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.97 -25.63 67.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.485 . . . . 1.95 110.27 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.7 ttp -73.05 -35.21 66.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.779 -0.646 . . . . 0.29999999999999999 110.269 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.716 HD11 HD23 ' A' ' 849' ' ' LEU . 6.0 mt -67.67 -50.76 56.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.825 -0.625 . . . . 0.46999999999999997 110.659 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.403 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.18 -2.28 36.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.11 -0.495 . . . . 0.48999999999999999 111.263 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.85 -4.92 2.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.001 0.429 . . . . 1.6799999999999999 110.211 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.403 ' H ' ' C ' ' A' ' 842' ' ' ALA . 3.1 m120 -147.67 -71.22 0.22 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.633 -0.712 . . . . 1.96 110.538 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 177.36 30.18 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.906 -0.588 . . . . 1.99 110.725 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . 0.621 ' HB3' HD23 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -96.0 142.16 28.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 2.2999999999999998 111.292 -179.602 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -136.49 -4.77 2.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.014 -0.539 . . . . 1.98 110.658 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.51 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 58.3 m-85 -91.33 136.26 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.957 -0.565 . . . . 1.0900000000000001 110.905 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.716 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -128.91 124.0 34.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.73999999999999999 111.122 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -85.46 169.14 13.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.075 -0.511 . . . . 1.52 110.851 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.706 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.0 OUTLIER . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.434 -0.348 . . . . 1.04 111.51 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.789 0.328 . . . . 1.22 111.038 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.817 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.46 95.44 1.12 Allowed 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.999 0.428 . . . . 0.93999999999999995 110.077 179.744 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -97.54 89.33 4.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.997 -0.547 . . . . 0.67000000000000004 111.0 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.27 137.51 32.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 1.5700000000000001 110.682 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.486 HD12 ' CE1' ' A' ' 848' ' ' PHE . 0.6 OUTLIER -62.61 107.49 0.96 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.114 0.483 . . . . 0.81000000000000005 110.45 179.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.427 ' HB ' ' O ' ' A' ' 847' ' ' LYS . 17.6 t -96.29 136.04 28.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.497 -0.774 . . . . 1.1799999999999999 110.712 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -97.3 165.32 12.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 1.3999999999999999 110.969 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.01 51.1 2.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.069 -0.514 . . . . 2.8500000000000001 110.651 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 1.5 p -164.53 -28.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.882 -0.599 . . . . 0.33000000000000002 110.605 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 26.4 m0 -47.75 130.83 14.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.608 -0.724 . . . . 0.29999999999999999 112.035 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.82 168.28 10.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.831 -0.803 . . . . 1.8899999999999999 108.831 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -53.34 -24.14 11.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.005 0.431 . . . . 0.63 110.329 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.65 ' O ' ' HG3' ' A' ' 796' ' ' MET . 17.5 m-20 -76.85 -60.61 2.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.846 -0.615 . . . . 2.0499999999999998 109.66 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -55.14 -21.83 14.64 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-O 121.093 0.473 . . . . 1.0700000000000001 109.804 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.595 HD22 ' CE2' ' A' ' 834' ' ' TRP . 40.2 tp -73.81 -60.24 2.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.535 -0.757 . . . . 0.93000000000000005 110.365 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.672 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 19.0 mm -57.1 -36.65 52.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.394 -0.821 . . . . 0.32000000000000001 111.988 -179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.65 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.2 mtt -69.59 -39.44 77.3 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.68 0.276 . . . . 1.53 110.837 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -65.34 -50.77 64.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.211 0.529 . . . . 0.38 110.05 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.551 ' O ' HG23 ' A' ' 802' ' ' ILE . 31.0 mt -61.4 -48.26 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 115.495 -0.775 . . . . 0.5 110.349 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.672 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.9 OUTLIER -56.35 -34.79 66.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.765 -0.652 . . . . 0.81000000000000005 110.952 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.96 -24.07 60.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.266 -0.425 . . . . 0.97999999999999998 110.715 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . 0.583 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -99.29 -2.21 37.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.075 -0.511 . . . . 2.25 111.419 -179.887 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.578 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.3 pp -116.13 -22.91 4.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.718 0.294 . . . . 0.75 111.533 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 55.7 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.344 -0.389 . . . . 1.53 110.9 -179.804 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo . . . . . 0 C--O 1.232 0.191 0 CA-C-O 120.771 0.238 . . . . 0.94999999999999996 112.395 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.548 HG12 HD13 ' A' ' 802' ' ' ILE . 5.5 pt -146.55 171.32 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.276 -0.42 . . . . 1.9399999999999999 111.07 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 19.4 p -128.82 -67.3 0.79 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.193 -0.458 . . . . 1.1599999999999999 111.129 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.3 mptt -83.51 137.84 33.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 2.6899999999999999 110.736 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -152.03 -178.18 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.296 -0.411 . . . . 0.83999999999999997 111.603 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.501 ' HE2' HG13 ' A' ' 827' ' ' VAL . 6.8 mmtt -120.24 155.02 34.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.86 -0.609 . . . . 0.84999999999999998 110.691 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.62 ' CE1' HG23 ' A' ' 826' ' ' VAL . 5.2 p90 -136.47 174.29 10.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.468 -0.333 . . . . 0.70999999999999996 111.133 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -96.09 106.58 18.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.213 -0.449 . . . . 1.9099999999999999 111.043 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.444 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 5.7 t70 -79.31 173.3 12.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.8 -0.637 . . . . 1.8 110.938 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -79.21 33.55 0.23 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.224 -0.444 . . . . 1.6200000000000001 111.19 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -128.85 8.88 5.77 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.225 -0.443 . . . . 1.6499999999999999 110.554 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 64.22 51.89 48.93 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.86 -0.686 . . . . 0.88 112.414 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -176.03 141.13 0.44 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.146 0.498 . . . . 1.8600000000000001 110.598 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.547 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 58.9 m-85 -66.73 145.25 55.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.636 -0.711 . . . . 0.64000000000000001 110.747 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.62 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.9 OUTLIER -138.51 178.1 4.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 0.96999999999999997 110.824 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . 0.501 HG13 ' HE2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -99.1 116.46 42.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.0 0.428 . . . . 0.56000000000000005 111.326 -179.736 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 4.3 tp -82.33 108.17 15.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.8 -0.636 . . . . 0.81000000000000005 110.876 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -58.09 -69.38 1.3 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.863 -0.684 . . . . 0.81000000000000005 112.691 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . 0.471 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 3.0 p -170.07 -143.42 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 110.497 -0.186 . . . . 1.3100000000000001 110.497 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.471 ' H ' ' HB2' ' A' ' 830' ' ' SER . 20.2 t70 -56.48 -19.17 14.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.716 0.293 . . . . 2.2000000000000002 110.831 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -70.47 -68.49 0.42 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.356 -0.384 . . . . 2.21 110.552 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.33 -12.22 28.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.399 -0.364 . . . . 0.72999999999999998 110.357 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.595 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.0 OUTLIER -82.68 -44.41 15.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.061 -0.518 . . . . 0.26000000000000001 110.363 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -35.25 80.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.049 -0.523 . . . . 1.98 109.947 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.11 -54.6 14.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.546 -0.752 . . . . 0.67000000000000004 110.079 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.82 -26.52 46.84 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.095 -0.502 . . . . 0.22 110.506 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -67.42 -50.13 60.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.075 -0.511 . . . . 0.84999999999999998 110.277 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -58.64 -24.5 61.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.938 -0.574 . . . . 1.95 110.136 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 6.7 ttp -74.86 -36.4 62.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.691 -0.686 . . . . 0.29999999999999999 110.444 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 17.0 mt -60.7 -43.23 98.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.082 -0.508 . . . . 0.46999999999999997 110.433 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.43 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -74.3 -27.39 60.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.545 . . . . 0.48999999999999999 111.181 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.35 7.63 0.99 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.048 -0.524 . . . . 1.6799999999999999 110.708 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 842' ' ' ALA . 24.1 m-80 -148.04 17.2 1.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.062 -0.517 . . . . 1.96 110.714 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.7 t30 60.22 12.59 3.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.17 -0.468 . . . . 1.99 110.872 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.16 171.01 15.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.973 -0.558 . . . . 2.2999999999999998 111.142 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . 0.427 ' O ' ' HB ' ' A' ' 785' ' ' VAL . 0.0 OUTLIER -152.21 -37.12 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.628 -0.714 . . . . 1.98 110.244 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.486 ' CE1' HD12 ' A' ' 784' ' ' LEU . 9.8 m-85 -83.49 147.14 27.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.019 -0.537 . . . . 1.0900000000000001 110.783 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.6 OUTLIER -123.38 132.63 54.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.219 -0.446 . . . . 0.73999999999999999 111.026 179.74 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.477 ' ND2' HG23 ' A' ' 782' ' ' THR . 3.1 m120 -85.65 154.15 21.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 1.52 110.936 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.817 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.331 -0.214 0 CA-C-N 116.21 -0.45 . . . . 1.04 111.047 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.407 ' HB ' HD22 ' A' ' 850' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.636 0.255 . . . . 1.22 111.097 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.881 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.79 99.58 2.01 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 109.097 -0.705 . . . . 0.93999999999999995 109.097 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.591 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -96.46 94.87 7.65 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.723 -0.671 . . . . 0.67000000000000004 110.945 -178.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.504 HD11 ' HB1' ' A' ' 797' ' ' ALA . 0.2 OUTLIER -100.23 104.84 16.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.521 -0.763 . . . . 1.5700000000000001 110.872 -179.755 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.44 114.08 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.105 -0.498 . . . . 0.81000000000000005 110.567 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.482 HG11 ' CH2' ' A' ' 834' ' ' TRP . 30.7 m -103.41 179.55 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.451 -0.795 . . . . 1.1799999999999999 111.434 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.5 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 5.1 tp10 -122.97 176.7 5.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.968 -0.56 . . . . 1.3999999999999999 110.842 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . 0.5 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 2.5 mttt -90.0 54.96 2.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 2.8500000000000001 110.751 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.4 p -171.44 -27.97 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.107 -0.497 . . . . 0.33000000000000002 111.058 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -50.33 126.13 14.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.816 -0.629 . . . . 0.29999999999999999 112.086 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.89 167.93 11.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.708 -0.849 . . . . 1.8899999999999999 108.708 178.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.465 ' O ' HG12 ' A' ' 795' ' ' ILE . 87.4 t80 -54.51 -27.15 36.11 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.659 -0.416 . . . . 0.63 110.179 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.58 ' O ' ' HG3' ' A' ' 796' ' ' MET . 30.4 m-20 -70.71 -56.49 6.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.008 -0.542 . . . . 2.0499999999999998 109.622 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.96 -31.09 66.53 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.138 -0.483 . . . . 1.0700000000000001 110.279 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.608 HD22 ' CE2' ' A' ' 834' ' ' TRP . 31.7 tp -65.86 -54.48 26.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.826 -0.625 . . . . 0.93000000000000005 110.468 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.667 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 26.8 mm -54.11 -29.89 19.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.499 -0.773 . . . . 0.32000000000000001 111.744 -179.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.58 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.8 mtp -69.03 -51.59 37.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.558 0.218 . . . . 1.53 110.623 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . 0.504 ' HB1' HD11 ' A' ' 783' ' ' LEU . . . -54.27 -50.85 66.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.072 0.463 . . . . 0.38 110.157 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 802' ' ' ILE . 63.6 mt -60.3 -53.37 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.63 -0.714 . . . . 0.5 110.556 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.759 HD21 ' HB3' ' A' ' 812' ' ' PRO . 0.2 OUTLIER -54.33 -27.24 34.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.482 -0.781 . . . . 0.81000000000000005 111.458 -179.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.11 -29.18 48.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.438 -0.346 . . . . 0.97999999999999998 111.099 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 801' ' ' LYS . 0.2 OUTLIER -93.14 -9.29 39.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.397 -0.365 . . . . 2.25 111.488 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.755 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.0 OUTLIER -100.75 -31.0 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.825 0.345 . . . . 0.75 111.278 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . 0.483 ' N ' HG13 ' A' ' 802' ' ' ILE . 69.0 p . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.272 -0.422 . . . . 1.53 110.817 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . 0.759 ' HB3' HD21 ' A' ' 799' ' ' ASN . 38.9 Cg_exo . . . . . 0 CA--C 1.527 0.133 0 CA-C-O 120.925 0.302 . . . . 0.94999999999999996 112.392 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.619 HG12 HD13 ' A' ' 802' ' ' ILE . 5.5 mm -119.6 161.78 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.038 -0.528 . . . . 1.9399999999999999 110.822 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . 0.582 HG23 ' H ' ' A' ' 815' ' ' LYS . 0.0 OUTLIER -131.26 -62.23 0.89 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.54 -0.3 . . . . 1.1599999999999999 111.414 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . 0.582 ' H ' HG23 ' A' ' 814' ' ' THR . 0.0 OUTLIER -82.13 142.41 32.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.37 -0.377 . . . . 2.6899999999999999 110.869 -179.835 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -155.59 167.93 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.066 -0.516 . . . . 0.83999999999999997 111.267 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.458 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 19.2 mmtt -105.41 149.6 25.99 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.99 -0.55 . . . . 0.84999999999999998 110.572 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.641 ' CE1' HG23 ' A' ' 826' ' ' VAL . 6.2 p90 -131.13 169.3 16.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.764 0.316 . . . . 0.70999999999999996 111.356 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -92.14 107.08 18.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.071 -0.513 . . . . 1.9099999999999999 110.884 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.409 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 13.4 t70 -79.0 173.91 12.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.737 -0.665 . . . . 1.8 110.964 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . 0.605 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 12.4 pt-20 -71.02 0.92 6.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.244 -0.434 . . . . 1.6200000000000001 111.439 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.61 13.79 32.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.399 -0.364 . . . . 1.6499999999999999 110.796 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 55.58 55.22 29.81 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.812 -0.708 . . . . 0.88 112.277 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -171.93 135.37 0.82 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.006 0.432 . . . . 1.8600000000000001 110.553 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.583 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 65.3 m-85 -63.67 131.43 47.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.879 -0.6 . . . . 0.64000000000000001 110.895 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.641 HG23 ' CE1' ' A' ' 818' ' ' TYR . 1.8 m -127.63 -179.07 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.234 -0.439 . . . . 0.96999999999999997 110.789 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 2.5 t -98.75 116.94 42.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.054 0.454 . . . . 0.56000000000000005 111.295 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.71 108.0 12.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.81000000000000005 110.689 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -56.8 -67.13 2.38 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.829 -0.7 . . . . 0.81000000000000005 112.692 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . 0.428 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -173.86 -137.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.421 -0.214 . . . . 1.3100000000000001 110.421 -179.791 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.431 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 28.3 t70 -59.88 -16.19 27.26 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.745 0.307 . . . . 2.2000000000000002 110.751 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.41 -69.43 0.4 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 2.21 110.854 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.91 -12.46 25.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.72999999999999998 110.519 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.608 ' CE2' HD22 ' A' ' 794' ' ' LEU . 3.4 t-105 -84.68 -39.67 18.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.277 -0.42 . . . . 0.26000000000000001 110.189 179.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.748 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.3 OUTLIER -70.28 -33.48 71.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 1.98 109.836 179.011 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 66.6 t -74.84 -55.9 10.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.476 -0.784 . . . . 0.67000000000000004 110.203 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -56.12 -27.27 53.32 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.211 -0.449 . . . . 0.22 110.413 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.748 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 25.5 mtmt -66.44 -51.38 57.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.005 -0.543 . . . . 0.84999999999999998 110.359 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.69 -28.22 68.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 1.95 110.178 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . 0.605 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 11.9 ttp -70.74 -36.71 73.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.715 -0.675 . . . . 0.29999999999999999 110.216 179.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.9 HD11 HD23 ' A' ' 849' ' ' LEU . 49.4 mt -67.04 -42.76 84.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.865 -0.607 . . . . 0.46999999999999997 110.914 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.431 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -72.01 -24.9 61.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.48999999999999999 111.235 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.04 6.11 1.01 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.309 -0.405 . . . . 1.6799999999999999 110.756 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 842' ' ' ALA . 65.1 m-80 -150.86 21.1 0.79 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.087 -0.506 . . . . 1.96 110.851 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.3 15.1 4.05 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.036 -0.529 . . . . 1.99 111.167 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.08 170.58 16.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.919 0.39 . . . . 2.2999999999999998 110.924 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -157.68 -22.28 0.09 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.92 -0.582 . . . . 1.98 111.272 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.591 ' HB3' HG22 ' A' ' 782' ' ' THR . 32.4 m-85 -86.4 122.49 30.43 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.841 0.353 . . . . 1.0900000000000001 111.174 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.9 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -105.86 121.45 44.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.014 -0.539 . . . . 0.73999999999999999 110.488 179.688 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.46 ' C ' HG13 ' A' ' 851' ' ' ILE . 14.1 m120 -76.82 141.27 40.75 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.457 -0.338 . . . . 1.52 111.394 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.881 HD12 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-N 116.194 -0.457 . . . . 1.04 111.421 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.565 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 1.5 mt . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.749 0.309 . . . . 1.22 111.054 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 1.056 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -142.61 86.04 1.93 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.704 -0.48 . . . . 0.93999999999999995 109.704 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.571 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 2.1 m -97.76 118.76 35.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.82 -0.627 . . . . 0.67000000000000004 111.33 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.536 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -129.65 -168.3 1.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.731 -0.668 . . . . 1.5700000000000001 111.031 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 784' ' ' LEU . 0.0 OUTLIER -108.05 119.92 40.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.685 -0.688 . . . . 0.81000000000000005 109.472 178.799 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.569 HG13 ' CE3' ' A' ' 789' ' ' TRP . 89.1 t -117.69 145.19 23.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.227 -0.442 . . . . 1.1799999999999999 111.623 -178.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 4.7 tp10 -95.15 168.31 10.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.939 -0.573 . . . . 1.3999999999999999 110.742 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . 0.411 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -85.25 16.52 3.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 2.8500000000000001 110.993 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.09 -26.18 2.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.955 -0.566 . . . . 0.33000000000000002 111.117 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . 0.569 ' CE3' HG13 ' A' ' 785' ' ' VAL . 39.2 m0 -52.85 120.36 5.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.067 -0.515 . . . . 0.29999999999999999 112.103 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . 0.811 HD21 ' HB3' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -94.05 160.4 14.73 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.54 -0.911 . . . . 1.8899999999999999 108.54 178.017 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.427 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 78.3 t80 -44.48 -34.86 2.22 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.542 0.21 . . . . 0.63 111.245 -178.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.811 ' HB3' HD21 ' A' ' 790' ' ' ASN . 33.8 t70 -68.62 -51.28 44.01 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.855 -0.424 . . . . 2.0499999999999998 109.855 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . 0.606 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.9 OUTLIER -61.23 -31.73 71.52 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.176 -0.466 . . . . 1.0700000000000001 110.32 179.218 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.569 HD22 ' CE2' ' A' ' 834' ' ' TRP . 29.8 tp -65.15 -52.98 51.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.648 -0.705 . . . . 0.93000000000000005 110.198 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.693 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 31.0 mm -54.36 -28.85 19.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.535 -0.757 . . . . 0.32000000000000001 111.212 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.609 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 6.1 mtp -67.35 -50.36 60.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.688 0.28 . . . . 1.53 110.443 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -55.06 -54.34 44.29 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.067 0.46 . . . . 0.38 110.144 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 65.4 mt -56.73 -51.01 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-N 115.765 -0.652 . . . . 0.5 110.394 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.693 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.8 OUTLIER -56.48 -26.66 54.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.536 -0.756 . . . . 0.81000000000000005 111.319 -179.764 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.75 -24.64 41.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.372 -0.376 . . . . 0.97999999999999998 111.194 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . 0.452 ' HB3' ' CE2' ' A' ' 781' ' ' PHE . 1.2 mptt -100.02 -6.78 25.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 2.25 111.334 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.592 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.4 pp -109.05 -32.45 2.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.771 0.32 . . . . 0.75 111.412 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . 0.563 ' HB2' HD12 ' A' ' 802' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--N 1.332 -0.191 0 CA-C-N 116.383 -0.371 . . . . 1.53 111.088 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . 0.569 ' HB2' HD21 ' A' ' 799' ' ' ASN . 42.8 Cg_endo . . . . . 0 C--O 1.232 0.183 0 CA-C-O 120.741 0.225 . . . . 0.94999999999999996 112.215 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.452 HD12 HG22 ' A' ' 816' ' ' ILE . 9.4 pt -140.18 162.68 24.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.344 -0.389 . . . . 1.9399999999999999 111.155 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 5.8 p -129.09 -43.36 1.33 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.182 -0.463 . . . . 1.1599999999999999 111.156 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.94 114.99 22.08 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.258 -0.428 . . . . 2.6899999999999999 110.925 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . 0.579 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -135.75 176.18 8.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.267 -0.424 . . . . 0.83999999999999997 111.443 -179.847 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.525 ' HE2' HG22 ' A' ' 827' ' ' VAL . 12.3 mmtt -128.16 136.39 51.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.959 -0.564 . . . . 0.84999999999999998 110.403 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.616 ' CE1' HG23 ' A' ' 826' ' ' VAL . 3.7 p90 -116.35 177.99 4.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.92 0.391 . . . . 0.70999999999999996 111.421 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . 0.481 HE21 ' HA2' ' A' ' 823' ' ' GLY . 11.2 tp60 -100.1 111.3 23.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.001 -0.545 . . . . 1.9099999999999999 110.741 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.443 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 6.5 t70 -79.37 175.17 10.84 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.681 -0.691 . . . . 1.8 110.953 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.37 40.19 0.56 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.252 -0.431 . . . . 1.6200000000000001 111.09 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -140.28 15.7 2.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.342 -0.39 . . . . 1.6499999999999999 110.781 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . 0.481 ' HA2' HE21 ' A' ' 819' ' ' GLN . . . 58.3 54.13 40.15 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.81 -0.71 . . . . 0.88 112.23 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -172.75 133.51 0.58 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.925 0.393 . . . . 1.8600000000000001 110.658 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.534 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 67.0 m-85 -66.37 142.77 57.5 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.013 -0.54 . . . . 0.64000000000000001 110.704 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.616 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.3 OUTLIER -133.42 172.34 16.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 0.96999999999999997 110.714 179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . 0.525 HG22 ' HE2' ' A' ' 817' ' ' LYS . 1.8 t -98.78 113.07 32.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 0.56000000000000005 111.153 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.68 116.93 20.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.747 -0.661 . . . . 0.81000000000000005 110.896 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -65.72 -64.25 3.55 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.866 -0.683 . . . . 0.81000000000000005 112.615 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.36 -142.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.533 0.206 . . . . 1.3100000000000001 110.629 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.552 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 11.1 t70 -57.08 -15.1 4.6 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.724 0.297 . . . . 2.2000000000000002 111.168 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.468 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.0 OUTLIER -73.44 -73.62 0.21 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.438 -0.347 . . . . 2.21 111.021 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -12.49 10.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.396 -0.366 . . . . 0.72999999999999998 110.646 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.569 ' CE2' HD22 ' A' ' 794' ' ' LEU . 3.7 t-105 -85.36 -39.85 17.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.385 -0.371 . . . . 0.26000000000000001 110.145 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.736 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -69.43 -35.42 75.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.133 0.492 . . . . 1.98 109.879 178.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 832' ' ' GLU . 25.2 t -73.46 -55.19 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.625 -0.716 . . . . 0.67000000000000004 110.071 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.8 -27.64 52.2 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.058 -0.519 . . . . 0.22 110.374 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.736 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.3 mtmt -66.92 -47.92 70.26 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.972 -0.558 . . . . 0.84999999999999998 110.22 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -62.64 -32.64 73.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.042 -0.526 . . . . 1.95 109.946 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -64.63 -31.32 72.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.732 -0.667 . . . . 0.29999999999999999 110.119 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.89 HD11 HD23 ' A' ' 849' ' ' LEU . 1.5 mt -72.02 -42.69 66.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.788 -0.642 . . . . 0.46999999999999997 110.814 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.422 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -69.25 -20.52 63.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.463 . . . . 0.48999999999999999 111.197 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -68.07 3.61 1.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.489 . . . . 1.6799999999999999 110.577 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.12 20.06 0.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 1.96 110.901 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 58.62 19.08 6.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 1.99 111.006 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . 0.728 ' HB3' HD23 ' A' ' 841' ' ' LEU . 2.3 mt-10 -71.59 143.03 49.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 2.2999999999999998 110.816 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' A' ' 784' ' ' LEU . 27.4 mttt -136.09 14.59 3.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 1.98 110.751 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.536 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 19.6 m-85 -119.49 128.62 54.14 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.139 -0.482 . . . . 1.0900000000000001 111.251 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.89 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -115.46 129.06 56.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.005 -0.543 . . . . 0.73999999999999999 110.724 179.821 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.447 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 3.2 m120 -94.81 142.32 27.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.089 -0.505 . . . . 1.52 111.183 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 1.056 HD12 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.333 -0.13 0 CA-C-N 116.52 -0.309 . . . . 1.04 111.235 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.444 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.705 0.288 . . . . 1.22 111.097 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.452 ' CB ' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -139.83 82.91 1.9 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.043 0.449 . . . . 0.93999999999999995 109.805 179.665 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.86 121.65 40.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.867 -0.606 . . . . 0.67000000000000004 111.458 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -112.58 -163.67 0.87 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.651 -0.704 . . . . 1.5700000000000001 110.629 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.414 HD12 ' HG3' ' A' ' 847' ' ' LYS . 0.3 OUTLIER -124.97 101.89 7.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.161 -0.472 . . . . 0.81000000000000005 110.341 179.503 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 31.4 m -93.36 165.13 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.985 -0.552 . . . . 1.1799999999999999 111.341 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.45 ' HG3' ' HE3' ' A' ' 787' ' ' LYS . 0.9 OUTLIER -116.99 175.57 5.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 1.3999999999999999 111.028 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . 0.45 ' HE3' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -89.17 54.89 3.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.181 0.515 . . . . 2.8500000000000001 110.735 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -168.31 -26.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.649 -0.705 . . . . 0.33000000000000002 110.587 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 27.3 m0 -52.08 126.11 17.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.693 -0.685 . . . . 0.29999999999999999 111.923 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . 0.534 HD22 ' HB2' ' A' ' 792' ' ' ASP . 0.1 OUTLIER -95.25 165.86 12.18 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.944 -0.761 . . . . 1.8899999999999999 108.944 178.314 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.401 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 92.0 t80 -51.42 -24.9 5.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.901 0.381 . . . . 0.63 110.297 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.64 ' O ' ' HG3' ' A' ' 796' ' ' MET . 1.5 m-20 -70.5 -62.89 1.22 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.017 -0.538 . . . . 2.0499999999999998 109.74 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . 0.532 ' H ' HD22 ' A' ' 790' ' ' ASN . 1.0 OUTLIER -53.34 -29.26 33.17 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.112 0.482 . . . . 1.0700000000000001 110.336 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.576 HD22 ' CE2' ' A' ' 834' ' ' TRP . 26.5 tp -67.96 -53.61 24.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.784 -0.644 . . . . 0.93000000000000005 110.235 179.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.642 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 21.9 mm -60.09 -30.9 46.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.599 -0.728 . . . . 0.32000000000000001 111.211 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.64 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 21.3 mtp -69.13 -51.79 34.82 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.339 -0.245 . . . . 1.53 110.339 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.32 -52.01 62.88 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.014 0.435 . . . . 0.38 110.067 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.501 ' O ' HG23 ' A' ' 802' ' ' ILE . 71.5 mt -58.53 -52.48 59.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.636 -0.711 . . . . 0.5 110.423 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.651 ' HA ' HG12 ' A' ' 802' ' ' ILE . 7.0 t-20 -56.64 -21.59 28.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.614 -0.721 . . . . 0.81000000000000005 111.215 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 22.3 t -79.29 -31.42 43.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.97999999999999998 110.618 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -94.91 -8.63 36.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.96 -0.564 . . . . 2.25 111.245 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.651 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.3 pt -111.03 -23.94 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.476 -0.329 . . . . 0.75 111.36 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . 0.476 ' N ' HG13 ' A' ' 802' ' ' ILE . 3.8 t . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 1.53 110.928 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo . . . . . 0 N--CA 1.465 -0.154 0 CA-C-O 120.834 0.264 . . . . 0.94999999999999996 112.427 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.512 HG12 HD13 ' A' ' 802' ' ' ILE . 35.0 pt -135.77 174.34 12.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.022 -0.535 . . . . 1.9399999999999999 111.046 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . 0.566 HG23 ' H ' ' A' ' 815' ' ' LYS . 0.0 OUTLIER -146.4 -60.75 0.31 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.238 -0.437 . . . . 1.1599999999999999 111.057 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . 0.566 ' H ' HG23 ' A' ' 814' ' ' THR . 1.5 tttp -92.44 126.81 37.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.293 -0.412 . . . . 2.6899999999999999 110.464 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -154.09 179.17 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.83999999999999997 111.564 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -109.42 -178.35 3.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.84999999999999998 110.215 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.468 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 15.3 p90 -156.38 164.11 38.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.716 0.293 . . . . 0.70999999999999996 111.048 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.7 OUTLIER -83.53 103.16 12.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.114 0.483 . . . . 1.9099999999999999 110.605 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -79.6 176.31 9.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.638 -0.71 . . . . 1.8 110.982 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . 0.475 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.2 OUTLIER -82.93 27.53 0.54 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 1.6200000000000001 110.954 179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.39 -0.52 14.47 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.239 -0.437 . . . . 1.6499999999999999 110.775 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 84.12 16.69 66.63 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.767 -0.73 . . . . 0.88 112.436 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -143.72 -145.41 0.17 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.743 0.306 . . . . 1.8600000000000001 110.561 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.468 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 97.4 m-85 -129.95 145.95 51.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.965 0.412 . . . . 0.64000000000000001 111.602 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.473 ' CG1' ' N ' ' A' ' 827' ' ' VAL . 10.0 t -122.55 163.99 20.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.645 -0.707 . . . . 0.96999999999999997 109.722 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . 0.473 ' N ' ' CG1' ' A' ' 826' ' ' VAL . 0.2 OUTLIER -97.65 107.52 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.065 0.459 . . . . 0.56000000000000005 111.296 -179.453 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.404 ' HG ' ' HB3' ' A' ' 833' ' ' ASP . 5.6 tt -79.6 136.8 36.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.652 -0.704 . . . . 0.81000000000000005 110.723 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -90.88 -59.39 1.41 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.654 -0.784 . . . . 0.81000000000000005 112.495 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -170.5 -141.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.358 -0.238 . . . . 1.3100000000000001 110.358 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -55.96 -23.52 32.69 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.666 0.27 . . . . 2.2000000000000002 110.896 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.585 ' O ' HG23 ' A' ' 836' ' ' VAL . 5.8 tt0 -64.88 -73.74 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.294 -0.412 . . . . 2.21 110.806 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . 0.404 ' HB3' ' HG ' ' A' ' 828' ' ' LEU . 0.4 OUTLIER -60.2 -12.59 9.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.301 -0.409 . . . . 0.72999999999999998 110.636 179.63 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.576 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.5 t-105 -81.37 -39.65 24.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.983 0.42 . . . . 0.26000000000000001 109.961 179.013 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -73.55 -28.87 62.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.999 -0.546 . . . . 1.98 109.68 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 832' ' ' GLU . 24.4 t -75.48 -53.99 14.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.585 -0.734 . . . . 0.67000000000000004 109.706 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.81 -29.63 65.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.661 -0.7 . . . . 0.22 110.457 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -67.46 -45.43 75.99 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.051 -0.522 . . . . 0.84999999999999998 110.518 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -61.76 -25.23 67.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.001 -0.545 . . . . 1.95 110.326 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . 0.475 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 18.1 ttp -75.67 -38.44 58.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.68 -0.691 . . . . 0.29999999999999999 110.418 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.686 HD11 HD23 ' A' ' 849' ' ' LEU . 12.1 mt -62.76 -53.2 57.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.044 -0.526 . . . . 0.46999999999999997 110.806 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.424 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -62.53 -22.51 66.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.48999999999999999 111.039 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -67.7 3.37 1.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.077 -0.51 . . . . 1.6799999999999999 110.661 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.454 ' HB2' ' OE2' ' A' ' 846' ' ' GLU . 0.0 OUTLIER -154.98 22.57 0.44 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.465 . . . . 1.96 110.935 -180.0 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.7 m120 58.09 19.67 6.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.1 -0.5 . . . . 1.99 111.208 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . 0.454 ' OE2' ' HB2' ' A' ' 844' ' ' ASN . 0.1 OUTLIER -82.0 148.48 28.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.296 -0.411 . . . . 2.2999999999999998 110.635 179.803 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . 0.414 ' HG3' HD12 ' A' ' 784' ' ' LEU . 0.2 OUTLIER -141.68 11.04 2.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 1.98 110.97 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.455 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 64.9 m-85 -107.18 126.3 52.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.118 -0.492 . . . . 1.0900000000000001 110.733 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.686 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -123.68 126.56 46.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.232 -0.44 . . . . 0.73999999999999999 111.09 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 21.2 m-20 -88.12 -176.3 5.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.051 -0.522 . . . . 1.52 110.732 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.452 HG13 ' CB ' ' A' ' 781' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.24 0 CA-C-O 120.811 0.339 . . . . 1.04 111.599 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.528 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.822 0.344 . . . . 1.22 111.151 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.506 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.13 92.32 1.42 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.128 0.49 . . . . 0.93999999999999995 110.025 179.617 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.4 96.3 8.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.818 -0.628 . . . . 0.67000000000000004 110.729 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.532 HD11 ' HG3' ' A' ' 801' ' ' LYS . 0.3 OUTLIER -99.38 132.14 44.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.674 -0.694 . . . . 1.5700000000000001 111.128 -179.365 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.551 HD12 ' HE1' ' A' ' 848' ' ' PHE . 8.5 tt -65.87 107.01 1.69 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.092 -0.504 . . . . 0.81000000000000005 110.392 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.426 HG11 ' CH2' ' A' ' 834' ' ' TRP . 28.3 m -102.01 173.92 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.521 . . . . 1.1799999999999999 111.357 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.435 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 0.7 OUTLIER -119.4 170.33 9.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 1.3999999999999999 110.833 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . 0.435 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -83.46 14.86 3.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 2.8500000000000001 111.026 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . 0.434 HG12 ' HG2' ' A' ' 786' ' ' GLU . 1.6 p -127.35 -27.44 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.922 -0.581 . . . . 0.33000000000000002 110.909 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -47.92 125.11 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.922 -0.581 . . . . 0.29999999999999999 112.007 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.74 165.93 12.46 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.134 -0.691 . . . . 1.8899999999999999 109.134 178.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -50.98 -26.42 5.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.023 0.439 . . . . 0.63 110.213 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.643 ' O ' ' HG3' ' A' ' 796' ' ' MET . 14.0 t70 -71.89 -61.41 1.8 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.863 -0.608 . . . . 2.0499999999999998 109.577 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -53.79 -24.12 14.27 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.07 -0.514 . . . . 1.0700000000000001 110.128 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.631 HD22 ' CE2' ' A' ' 834' ' ' TRP . 32.5 tp -73.56 -57.34 4.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 0.93000000000000005 110.497 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.696 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.2 mm -58.0 -33.7 46.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.689 -0.687 . . . . 0.32000000000000001 111.901 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.643 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 3.3 mtp -72.32 -44.42 62.7 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.107 -0.237 . . . . 1.53 111.001 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -61.78 -47.29 85.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.167 0.508 . . . . 0.38 109.738 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.453 ' O ' HG23 ' A' ' 802' ' ' ILE . 17.5 mt -63.39 -49.64 81.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.478 -0.783 . . . . 0.5 110.126 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.696 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.6 OUTLIER -57.77 -23.76 53.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.838 -0.619 . . . . 0.81000000000000005 110.909 179.568 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.19 -27.74 38.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.97999999999999998 110.6 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . 0.532 ' HG3' HD11 ' A' ' 783' ' ' LEU . 8.1 mmpt? -97.82 -4.18 37.31 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.052 -0.522 . . . . 2.25 111.394 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.2 pp -113.8 -31.16 2.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.7 0.286 . . . . 0.75 111.422 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . 0.402 ' N ' HG13 ' A' ' 802' ' ' ILE . 1.2 m . . . . . 0 C--N 1.33 -0.242 0 CA-C-O 120.926 0.393 . . . . 1.53 111.139 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . 0.551 ' HB2' HD21 ' A' ' 799' ' ' ASN . 53.7 Cg_endo . . . . . 0 C--O 1.232 0.202 0 CA-C-O 120.844 0.269 . . . . 0.94999999999999996 112.53 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.496 HG12 HD13 ' A' ' 802' ' ' ILE . 3.4 pt -145.0 163.57 13.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.162 -0.472 . . . . 1.9399999999999999 111.1 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 1.2 p -133.16 -63.01 0.78 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.313 -0.403 . . . . 1.1599999999999999 111.275 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -82.14 126.11 31.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 2.6899999999999999 110.96 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -153.53 174.88 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.83999999999999997 111.212 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.453 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 15.0 mttt -115.37 152.99 31.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.84999999999999998 110.81 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.43 ' CE2' ' HB2' ' A' ' 828' ' ' LEU . 6.9 p90 -129.35 179.26 5.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.379 -0.373 . . . . 0.70999999999999996 110.898 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . 0.529 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -92.86 115.7 28.36 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.461 0.648 . . . . 1.9099999999999999 110.748 179.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -93.18 177.45 6.05 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 114.859 -1.064 . . . . 1.8 111.132 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -78.92 13.31 1.78 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.103 -0.499 . . . . 1.6200000000000001 111.113 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.48 4.7 46.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.427 . . . . 1.6499999999999999 110.628 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 75.72 10.48 84.85 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.914 -0.66 . . . . 0.88 112.475 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.64 -149.85 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.752 0.31 . . . . 1.8600000000000001 110.472 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.41 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 48.5 m-85 -128.41 139.75 52.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.384 -0.371 . . . . 0.64000000000000001 110.913 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.453 ' C ' ' HD3' ' A' ' 817' ' ' LYS . 8.9 m -123.39 173.15 9.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.419 -0.355 . . . . 0.96999999999999997 110.745 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -98.75 123.53 51.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.036 0.446 . . . . 0.56000000000000005 111.492 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 834' ' ' TRP . 5.3 tp -81.76 109.73 16.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.81000000000000005 110.723 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -64.5 -60.72 6.7 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.811 -0.709 . . . . 0.81000000000000005 112.644 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . 0.446 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -171.23 -142.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.476 -0.194 . . . . 1.3100000000000001 110.476 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.446 ' H ' ' HB3' ' A' ' 830' ' ' SER . 6.0 p-10 -61.67 -15.4 39.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.896 0.379 . . . . 2.2000000000000002 110.91 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.472 ' O ' HG23 ' A' ' 836' ' ' VAL . 44.4 mt-10 -73.72 -68.8 0.48 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.229 -0.441 . . . . 2.21 110.784 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.18 -13.52 18.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.308 -0.405 . . . . 0.72999999999999998 110.546 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.631 ' CE2' HD22 ' A' ' 794' ' ' LEU . 2.2 t-105 -81.72 -47.48 12.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.198 -0.455 . . . . 0.26000000000000001 110.037 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.31 -32.92 74.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.982 -0.554 . . . . 1.98 109.877 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 832' ' ' GLU . 58.9 t -74.04 -53.93 16.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.474 -0.785 . . . . 0.67000000000000004 109.97 179.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -53.39 -28.43 29.36 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.03 -0.532 . . . . 0.22 110.185 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.506 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 2.0 mtpp -67.73 -47.9 68.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.765 -0.652 . . . . 0.84999999999999998 110.366 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -60.17 -28.44 67.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.073 -0.512 . . . . 1.95 110.205 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 19.4 ttp -69.92 -39.44 76.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.825 -0.625 . . . . 0.29999999999999999 110.278 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.403 HD22 ' HB3' ' A' ' 846' ' ' GLU . 26.6 mt -66.59 -48.87 68.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.923 -0.58 . . . . 0.46999999999999997 110.705 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . . . . . . . . . . . -63.02 -23.47 67.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 0.48999999999999999 110.957 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.36 -0.81 2.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.039 -0.528 . . . . 1.6799999999999999 110.452 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.41 20.36 1.71 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.8 -0.637 . . . . 1.96 110.637 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.66 25.06 14.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.976 -0.556 . . . . 1.99 111.238 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . 0.403 ' HB3' HD22 ' A' ' 841' ' ' LEU . 2.1 mm-40 -85.48 171.85 11.46 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.48 -0.327 . . . . 2.2999999999999998 110.727 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 784' ' ' LEU . 15.3 pttt -159.85 11.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.31 -0.405 . . . . 1.98 111.414 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.551 ' HE1' HD12 ' A' ' 784' ' ' LEU . 29.4 m-85 -120.83 124.39 44.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.893 0.377 . . . . 1.0900000000000001 111.068 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.53 ' HG ' ' HZ3' ' A' ' 834' ' ' TRP . 0.7 OUTLIER -101.82 116.24 32.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.06 -0.518 . . . . 0.73999999999999999 110.178 179.55 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.529 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 7.2 m120 -72.16 162.69 29.11 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.058 -0.519 . . . . 1.52 111.302 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.528 ' O ' ' HA ' ' A' ' 780' ' ' ILE . 3.5 mm . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 116.208 -0.451 . . . . 1.04 111.029 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.427 ' HB ' ' OD1' ' A' ' 850' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.557 0.217 . . . . 1.22 111.029 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.752 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -144.37 87.15 1.86 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.089 0.471 . . . . 0.93999999999999995 110.078 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.455 HG23 ' OD1' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -98.19 91.69 5.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.655 -0.702 . . . . 0.67000000000000004 111.229 -179.336 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.17 144.61 26.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.804 -0.634 . . . . 1.5700000000000001 110.956 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.409 ' HB2' ' HE1' ' A' ' 848' ' ' PHE . 1.2 tt -85.01 114.45 22.18 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.252 -0.431 . . . . 0.81000000000000005 110.316 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.442 HG11 ' CH2' ' A' ' 834' ' ' TRP . 34.9 m -98.51 -173.69 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.92 -0.582 . . . . 1.1799999999999999 111.497 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.562 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 3.9 tp10 -133.86 167.92 19.69 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.952 -0.567 . . . . 1.3999999999999999 110.676 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . 0.562 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -82.8 49.52 1.51 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.253 -0.43 . . . . 2.8500000000000001 110.781 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -166.09 -25.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.138 -0.483 . . . . 0.33000000000000002 110.987 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -52.65 123.86 12.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.855 -0.612 . . . . 0.29999999999999999 111.922 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . 0.473 HD22 ' HB2' ' A' ' 792' ' ' ASP . 0.0 OUTLIER -92.23 168.76 11.11 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.804 -0.813 . . . . 1.8899999999999999 108.804 178.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.428 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 63.3 t80 -53.56 -26.11 20.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.139 0.495 . . . . 0.63 110.252 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.615 ' O ' ' HG3' ' A' ' 796' ' ' MET . 2.5 m-20 -70.18 -63.72 1.03 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.694 -0.685 . . . . 2.0499999999999998 109.766 178.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . 0.439 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.4 OUTLIER -52.97 -29.8 31.11 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.223 -0.444 . . . . 1.0700000000000001 110.323 179.311 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.591 HD22 ' CE2' ' A' ' 834' ' ' TRP . 30.2 tp -66.86 -54.32 23.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.824 -0.626 . . . . 0.93000000000000005 110.429 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.67 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.9 mm -59.52 -33.06 50.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.639 -0.709 . . . . 0.32000000000000001 111.621 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.615 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 4.7 mtt -68.28 -52.78 29.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.657 0.265 . . . . 1.53 110.499 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.42 -52.89 57.93 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.203 -0.453 . . . . 0.38 110.039 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.484 ' O ' HG12 ' A' ' 802' ' ' ILE . 93.4 mt -57.05 -52.39 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.757 -0.656 . . . . 0.5 110.583 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.683 ' HA ' HG12 ' A' ' 802' ' ' ILE . 1.1 t-20 -54.68 -29.82 53.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.502 -0.772 . . . . 0.81000000000000005 111.379 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 29.5 t -75.88 -26.25 56.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.468 -0.333 . . . . 0.97999999999999998 111.017 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -101.57 -0.43 34.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.273 -0.422 . . . . 2.25 111.566 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.683 HG12 ' HA ' ' A' ' 799' ' ' ASN . 14.0 pt -117.01 -26.38 2.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.681 0.276 . . . . 0.75 111.628 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 21.6 p . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 120.979 0.419 . . . . 1.53 111.124 -179.966 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . 0.5 ' HB2' HD21 ' A' ' 799' ' ' ASN . 68.9 Cg_endo . . . . . 0 C--O 1.231 0.167 0 CA-C-O 120.847 0.269 . . . . 0.94999999999999996 112.284 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.492 HG13 HD12 ' A' ' 802' ' ' ILE . 2.1 mt -128.52 151.48 35.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.095 -0.502 . . . . 1.9399999999999999 111.364 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.39 -71.44 0.74 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.021 -0.536 . . . . 1.1599999999999999 110.834 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -83.88 131.62 34.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 2.6899999999999999 110.592 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -151.61 -174.72 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.307 -0.406 . . . . 0.83999999999999997 111.448 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -116.21 175.38 5.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.567 . . . . 0.84999999999999998 110.173 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.63 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 22.7 p90 -148.44 166.28 28.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.921 0.391 . . . . 0.70999999999999996 111.112 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . 0.513 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 1.9 tp60 -96.39 108.45 20.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 1.9099999999999999 110.577 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.426 ' HB3' ' CG2' ' A' ' 826' ' ' VAL . 0.1 OUTLIER -79.12 -178.2 6.03 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.756 -0.657 . . . . 1.8 111.064 -179.834 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . 0.514 ' HG2' ' HG3' ' A' ' 840' ' ' MET . 3.2 pt-20 -87.2 33.99 0.68 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.277 -0.42 . . . . 1.6200000000000001 111.59 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -139.17 14.93 2.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.36 -0.382 . . . . 1.6499999999999999 110.735 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 59.84 59.13 11.05 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.842 -0.694 . . . . 0.88 112.237 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -169.36 132.59 1.28 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.965 0.412 . . . . 1.8600000000000001 110.493 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.583 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 49.4 m-85 -73.9 126.51 30.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 0.64000000000000001 111.018 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.63 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 1.3 t -108.27 170.62 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.903 -0.59 . . . . 0.96999999999999997 111.076 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . 0.501 ' H ' HG12 ' A' ' 826' ' ' VAL . 1.4 t -99.65 107.0 19.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.33 -0.396 . . . . 0.56000000000000005 111.197 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.89 110.19 18.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.53 . . . . 0.81000000000000005 110.736 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -62.42 -65.11 3.36 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.858 -0.686 . . . . 0.81000000000000005 112.605 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 85.1 p -170.2 -131.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.495 -0.187 . . . . 1.3100000000000001 110.495 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -62.8 -11.57 18.73 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.786 0.327 . . . . 2.2000000000000002 110.906 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -79.07 -68.95 0.61 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.236 -0.438 . . . . 2.21 110.954 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.85 -11.99 21.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.297 -0.41 . . . . 0.72999999999999998 110.568 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.591 ' CE2' HD22 ' A' ' 794' ' ' LEU . 0.9 OUTLIER -81.31 -45.2 16.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.309 -0.405 . . . . 0.26000000000000001 110.019 179.267 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.69 -36.18 80.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.958 -0.564 . . . . 1.98 109.957 178.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 87.9 t -70.2 -53.88 21.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.51 -0.768 . . . . 0.67000000000000004 110.06 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.21 -25.06 58.45 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.086 -0.507 . . . . 0.22 109.981 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 1.4 mtpp -65.4 -49.34 69.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.799 -0.637 . . . . 0.84999999999999998 110.096 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.37 -27.07 67.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.866 -0.606 . . . . 1.95 110.449 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . 0.514 ' HG3' ' HG2' ' A' ' 821' ' ' GLU . 10.8 ttp -74.34 -38.23 63.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.945 -0.57 . . . . 0.29999999999999999 110.515 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.616 HD11 HD23 ' A' ' 849' ' ' LEU . 14.3 mt -63.13 -42.24 99.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.085 -0.507 . . . . 0.46999999999999997 110.757 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -68.16 -23.86 64.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.506 . . . . 0.48999999999999999 111.324 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.41 4.21 1.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 1.6799999999999999 110.639 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.445 ' H ' ' C ' ' A' ' 842' ' ' ALA . 35.5 m-80 -151.88 14.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 1.96 110.867 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.9 m120 62.25 14.9 7.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.148 -0.478 . . . . 1.99 111.291 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.04 169.61 9.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.389 . . . . 2.2999999999999998 110.864 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . 0.402 ' O ' HG22 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -151.62 -30.67 0.17 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.337 -0.392 . . . . 1.98 111.036 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.409 ' HE1' ' HB2' ' A' ' 784' ' ' LEU . 26.0 m-85 -79.53 149.51 31.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.297 -0.411 . . . . 1.0900000000000001 110.667 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.616 HD23 HD11 ' A' ' 841' ' ' LEU . 0.2 OUTLIER -136.27 114.71 11.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.219 -0.446 . . . . 0.73999999999999999 111.161 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.513 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 24.8 m-20 -72.36 173.41 8.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.292 -0.413 . . . . 1.52 110.718 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.752 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--N 1.332 -0.159 0 CA-C-N 116.414 -0.357 . . . . 1.04 111.492 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.46 0.063 0 CA-C-O 120.676 0.274 . . . . 1.22 110.792 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.563 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -153.86 89.7 1.33 Allowed 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.919 0.39 . . . . 0.93999999999999995 110.399 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.521 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.1 OUTLIER -98.36 93.17 6.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.985 -0.552 . . . . 0.67000000000000004 111.111 -179.564 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.76 161.08 14.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.69 -0.686 . . . . 1.5700000000000001 110.886 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.464 HD12 ' HB2' ' A' ' 847' ' ' LYS . 0.3 OUTLIER -96.56 111.79 23.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.81000000000000005 110.269 179.448 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.496 HG11 ' CH2' ' A' ' 834' ' ' TRP . 30.0 m -97.52 -171.41 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.101 -0.499 . . . . 1.1799999999999999 111.433 -179.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.422 ' O ' ' HD2' ' A' ' 838' ' ' LYS . 0.8 OUTLIER -138.78 170.86 15.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.045 -0.525 . . . . 1.3999999999999999 110.838 -179.771 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -85.76 49.98 1.88 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.055 0.455 . . . . 2.8500000000000001 110.512 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.6 p -165.21 -27.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.947 -0.569 . . . . 0.33000000000000002 110.791 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 30.3 m0 -52.6 122.75 9.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.921 -0.582 . . . . 0.29999999999999999 111.85 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . 0.643 HD21 ' HB2' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -95.97 159.22 15.08 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.874 -0.787 . . . . 1.8899999999999999 108.874 178.372 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.481 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 86.4 t80 -44.52 -33.01 1.59 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.698 0.285 . . . . 0.63 111.31 -178.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.643 ' HB2' HD21 ' A' ' 790' ' ' ASN . 2.3 m-20 -69.24 -51.91 32.89 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.925 -0.398 . . . . 2.0499999999999998 109.925 178.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . 0.613 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.6 OUTLIER -61.11 -29.53 69.82 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 120.995 0.426 . . . . 1.0700000000000001 110.247 179.205 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.559 HD22 ' CE2' ' A' ' 834' ' ' TRP . 34.2 tp -67.17 -52.32 42.82 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.825 -0.625 . . . . 0.93000000000000005 110.384 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.669 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 32.8 mm -57.03 -29.09 30.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.549 -0.751 . . . . 0.32000000000000001 111.706 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.592 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 10.1 mtt -67.94 -53.43 26.35 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.668 0.271 . . . . 1.53 110.336 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.0 -54.35 36.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.144 -0.48 . . . . 0.38 110.117 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 68.5 mt -55.64 -51.1 62.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-N 115.765 -0.652 . . . . 0.5 110.356 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.669 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.9 OUTLIER -56.06 -28.45 57.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.624 -0.716 . . . . 0.81000000000000005 111.338 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 43.0 t -77.24 -23.51 51.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.278 -0.419 . . . . 0.97999999999999998 110.875 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.07 0.24 27.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 2.25 111.414 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.582 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.7 pt -120.35 -22.21 3.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.571 -0.286 . . . . 0.75 111.393 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.389 -0.369 . . . . 1.53 110.999 -179.926 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo . . . . . 0 C--O 1.232 0.199 0 CA-C-O 120.824 0.26 . . . . 0.94999999999999996 112.257 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.429 HG13 ' CD1' ' A' ' 802' ' ' ILE . 2.3 mt -125.64 149.26 30.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.064 -0.516 . . . . 1.9399999999999999 111.337 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 2.9 p -122.89 -44.42 2.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.996 -0.547 . . . . 1.1599999999999999 110.836 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.08 130.47 41.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 2.6899999999999999 110.712 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -152.08 168.54 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.972 0.415 . . . . 0.83999999999999997 111.409 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.471 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 16.7 mmtt -113.66 136.9 52.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.784 -0.644 . . . . 0.84999999999999998 110.385 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.592 ' CE1' HG23 ' A' ' 826' ' ' VAL . 4.2 p90 -114.85 173.32 6.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.811 0.338 . . . . 0.70999999999999996 111.274 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -100.38 108.29 20.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.081 -0.509 . . . . 1.9099999999999999 110.504 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.461 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 4.1 t70 -79.08 173.6 12.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.824 -0.626 . . . . 1.8 110.829 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.11 10.09 2.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.245 -0.434 . . . . 1.6200000000000001 111.043 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.86 10.38 41.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 1.6499999999999999 110.848 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 61.71 51.73 55.46 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.859 -0.686 . . . . 0.88 112.468 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.96 141.87 0.27 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.024 0.44 . . . . 1.8600000000000001 110.429 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.49 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 63.6 m-85 -66.15 142.85 57.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.836 -0.62 . . . . 0.64000000000000001 110.488 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.592 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -133.1 173.03 15.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.219 -0.446 . . . . 0.96999999999999997 110.486 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.57 113.71 34.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.931 0.396 . . . . 0.56000000000000005 111.42 -179.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.9 tt -80.25 115.7 19.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.776 -0.647 . . . . 0.81000000000000005 110.952 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -61.52 -69.25 1.35 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.852 -0.69 . . . . 0.81000000000000005 112.549 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . 0.48 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 1.2 p -170.51 -140.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 110.442 -0.207 . . . . 1.3100000000000001 110.442 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.48 ' H ' ' HB2' ' A' ' 830' ' ' SER . 0.9 OUTLIER -55.61 -24.05 30.98 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.745 0.307 . . . . 2.2000000000000002 111.033 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -64.94 0.8 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.392 -0.367 . . . . 2.21 110.757 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.83 -13.92 28.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.72999999999999998 110.641 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.559 ' CE2' HD22 ' A' ' 794' ' ' LEU . 5.3 t-105 -86.58 -44.25 12.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.381 -0.372 . . . . 0.26000000000000001 110.192 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -64.84 -27.7 69.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.189 0.518 . . . . 1.98 109.835 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 88.4 t -82.54 -58.32 3.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.474 -0.785 . . . . 0.67000000000000004 110.108 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -52.94 -30.96 37.64 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.135 -0.484 . . . . 0.22 110.533 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' A' ' 786' ' ' GLU . 11.9 ttpt -69.66 -52.18 28.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.801 -0.636 . . . . 0.84999999999999998 109.979 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.32 -26.55 61.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.438 -0.801 . . . . 1.95 110.162 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 12.3 ttp -70.83 -40.87 72.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.772 -0.649 . . . . 0.29999999999999999 110.232 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.84 HD11 HD23 ' A' ' 849' ' ' LEU . 17.4 mt -62.27 -35.22 78.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.736 -0.665 . . . . 0.46999999999999997 110.814 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -73.82 -22.26 59.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.321 -0.399 . . . . 0.48999999999999999 111.178 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -69.77 6.27 1.22 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 1.6799999999999999 110.667 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.441 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.03 22.36 0.5 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.028 -0.533 . . . . 1.96 110.852 -179.902 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 58.05 16.12 3.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.102 -0.499 . . . . 1.99 111.181 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . 0.464 ' HB3' HD22 ' A' ' 841' ' ' LEU . 3.7 mt-10 -82.72 140.39 33.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 2.2999999999999998 110.807 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . 0.464 ' HB2' HD12 ' A' ' 784' ' ' LEU . 0.1 OUTLIER -135.74 30.6 3.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 1.98 110.759 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.521 ' HB3' HG22 ' A' ' 782' ' ' THR . 8.9 m-85 -125.88 126.0 43.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.117 -0.492 . . . . 1.0900000000000001 110.889 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.84 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -115.36 117.77 31.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 0.73999999999999999 110.502 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.444 ' C ' HG12 ' A' ' 851' ' ' ILE . 1.9 m-20 -84.21 152.91 23.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.261 -0.427 . . . . 1.52 111.481 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.563 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.333 -0.112 0 CA-C-N 116.088 -0.505 . . . . 1.04 111.19 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.487 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.582 0.229 . . . . 1.22 110.702 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.797 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.2 OUTLIER -158.23 93.03 1.2 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.982 0.42 . . . . 0.93999999999999995 110.138 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.97 92.21 5.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.024 -0.535 . . . . 0.67000000000000004 110.989 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.08 139.89 30.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.741 -0.663 . . . . 1.5700000000000001 110.962 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.614 HD12 ' HE1' ' A' ' 848' ' ' PHE . 6.4 tt -72.32 104.21 3.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.935 0.398 . . . . 0.81000000000000005 110.59 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.611 HG11 ' CZ2' ' A' ' 834' ' ' TRP . 67.8 t -94.68 147.3 5.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.018 -0.537 . . . . 1.1799999999999999 111.372 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -96.06 170.82 9.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 1.3999999999999999 110.548 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.44 54.18 3.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.359 -0.382 . . . . 2.8500000000000001 110.762 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.5 p -166.75 -24.07 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.108 -0.496 . . . . 0.33000000000000002 111.036 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . 0.474 ' CE3' HG13 ' A' ' 785' ' ' VAL . 38.2 m0 -53.51 122.28 9.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.081 -0.509 . . . . 0.29999999999999999 112.034 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . 0.767 HD21 ' HB2' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -95.33 158.12 15.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.613 -0.884 . . . . 1.8899999999999999 108.613 178.294 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.496 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 92.7 t80 -42.54 -33.81 0.75 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.748 0.308 . . . . 0.63 111.336 -178.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.767 ' HB2' HD21 ' A' ' 790' ' ' ASN . 1.5 m-20 -69.02 -55.01 12.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.791 -0.448 . . . . 2.0499999999999998 109.791 178.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . 0.608 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.7 OUTLIER -59.56 -29.71 68.12 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 120.974 0.416 . . . . 1.0700000000000001 110.498 179.302 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.578 HD22 ' CE2' ' A' ' 834' ' ' TRP . 32.4 tp -66.27 -52.95 42.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.897 -0.592 . . . . 0.93000000000000005 110.217 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.692 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.3 mm -57.26 -31.84 39.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.47 -0.786 . . . . 0.32000000000000001 111.527 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.645 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.2 mtt -68.17 -53.85 22.12 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.983 -0.287 . . . . 1.53 110.539 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -52.27 -53.68 40.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.027 0.442 . . . . 0.38 110.085 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.491 ' O ' HG12 ' A' ' 802' ' ' ILE . 94.2 mt -56.81 -53.2 45.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.668 -0.696 . . . . 0.5 110.509 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.692 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -53.52 -28.0 28.8 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.648 -0.705 . . . . 0.81000000000000005 111.285 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.07 -30.91 61.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.466 -0.334 . . . . 0.97999999999999998 111.065 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.39 0.74 45.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.326 -0.397 . . . . 2.25 111.512 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 4.1 pt -122.4 -14.65 6.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.67 0.272 . . . . 0.75 111.611 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 2.2 t . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.773 0.321 . . . . 1.53 111.198 -179.893 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo . . . . . 0 C--O 1.23 0.115 0 CA-C-O 120.773 0.239 . . . . 0.94999999999999996 112.08 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 14.5 mm -110.56 152.35 12.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.455 . . . . 1.9399999999999999 111.002 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.58 -56.18 1.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 1.1599999999999999 111.162 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . 0.402 ' HE2' HG12 ' A' ' 827' ' ' VAL . 1.3 tttt -92.59 118.47 31.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.247 -0.433 . . . . 2.6899999999999999 110.872 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . 0.574 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -134.61 169.22 21.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.093 -0.503 . . . . 0.83999999999999997 111.299 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.401 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 12.4 mmtt -107.64 172.26 6.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.969 -0.56 . . . . 0.84999999999999998 110.553 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.599 ' CE1' HG23 ' A' ' 826' ' ' VAL . 11.0 p90 -156.19 153.03 28.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.02 0.438 . . . . 0.70999999999999996 111.524 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -80.04 106.65 12.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.763 -0.653 . . . . 1.9099999999999999 110.694 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.412 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 6.9 t0 -78.75 178.51 7.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.552 -0.749 . . . . 1.8 110.819 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -80.11 41.58 0.53 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.227 -0.442 . . . . 1.6200000000000001 111.236 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -139.76 10.87 2.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 1.6499999999999999 110.759 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 62.9 50.15 66.28 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.852 -0.69 . . . . 0.88 112.452 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -173.96 134.95 0.47 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.985 0.421 . . . . 1.8600000000000001 110.659 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -64.17 148.41 50.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.883 -0.599 . . . . 0.64000000000000001 110.778 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.599 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -136.93 176.56 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.96999999999999997 110.642 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . 0.402 HG12 ' HE2' ' A' ' 815' ' ' LYS . 0.2 OUTLIER -99.24 110.91 27.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.914 0.387 . . . . 0.56000000000000005 111.138 -179.774 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 5.9 tt -79.69 124.07 28.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.81000000000000005 110.869 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -69.87 -66.16 2.32 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.812 -0.709 . . . . 0.81000000000000005 112.453 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.02 -140.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.467 0.175 . . . . 1.3100000000000001 110.617 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.429 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 1.9 p30 -58.12 -18.72 27.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.779 0.323 . . . . 2.2000000000000002 111.048 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.419 ' O ' HG23 ' A' ' 836' ' ' VAL . 2.6 mt-10 -72.23 -68.14 0.49 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.261 -0.427 . . . . 2.21 110.715 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.88 -12.27 23.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.312 -0.404 . . . . 0.72999999999999998 110.668 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.611 ' CZ2' HG11 ' A' ' 785' ' ' VAL . 2.1 t-105 -85.23 -41.8 15.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.26000000000000001 110.249 179.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.553 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -68.33 -36.7 79.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.892 -0.594 . . . . 1.98 109.489 178.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 832' ' ' GLU . 64.5 t -70.62 -55.27 14.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.354 -0.839 . . . . 0.67000000000000004 109.913 179.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.21 -24.34 53.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.953 -0.567 . . . . 0.22 110.533 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.553 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 28.7 mtmt -71.42 -49.63 39.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 0.84999999999999998 110.366 179.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 0.5 OUTLIER -61.26 -21.91 64.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.977 -0.556 . . . . 1.95 110.214 179.424 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.6 ttp -77.79 -36.39 50.48 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.704 -0.68 . . . . 0.29999999999999999 110.454 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.877 HD11 HD23 ' A' ' 849' ' ' LEU . 17.2 mt -66.1 -48.8 69.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 0.46999999999999997 110.629 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.446 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.81 -30.5 71.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.165 -0.47 . . . . 0.48999999999999999 111.097 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 0.7 OUTLIER -69.27 5.86 1.16 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.154 -0.476 . . . . 1.6799999999999999 110.593 179.741 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.446 ' H ' ' C ' ' A' ' 842' ' ' ALA . 9.0 m-80 -143.2 19.36 1.92 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 1.96 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 62.06 9.96 3.4 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.115 -0.493 . . . . 1.99 111.346 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.33 174.36 10.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.499 -0.319 . . . . 2.2999999999999998 110.909 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -157.65 -32.63 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 1.98 110.84 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.614 ' HE1' HD12 ' A' ' 784' ' ' LEU . 2.3 m-85 -80.27 147.95 30.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 1.0900000000000001 110.86 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.877 HD23 HD11 ' A' ' 841' ' ' LEU . 0.6 OUTLIER -125.01 128.38 48.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 0.73999999999999999 111.011 -179.857 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.524 ' O ' HD13 ' A' ' 849' ' ' LEU . 6.0 m120 -79.15 160.08 27.15 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.173 -0.467 . . . . 1.52 110.978 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.797 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.1 mm . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.439 -0.346 . . . . 1.04 111.63 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.515 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.621 0.248 . . . . 1.22 110.836 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.812 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.24 98.39 1.29 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.043 0.449 . . . . 0.93999999999999995 109.873 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.614 HG23 ' ND2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -96.73 86.97 4.2 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.824 -0.626 . . . . 0.67000000000000004 110.678 -179.442 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.491 ' O ' HG23 ' A' ' 785' ' ' VAL . 0.2 OUTLIER -82.11 117.43 22.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.244 -0.889 . . . . 1.5700000000000001 110.991 -179.723 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.442 HD12 ' CE1' ' A' ' 848' ' ' PHE . 0.7 OUTLIER -63.12 110.93 2.0 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.085 0.469 . . . . 0.81000000000000005 110.299 179.672 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.72 HG11 ' HZ2' ' A' ' 834' ' ' TRP . 46.8 t -107.03 152.78 8.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.708 -0.678 . . . . 1.1799999999999999 111.703 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.402 ' N ' HG12 ' A' ' 785' ' ' VAL . 1.0 OUTLIER -101.05 172.04 7.26 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.803 -0.635 . . . . 1.3999999999999999 110.416 179.4 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.27 53.24 2.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.962 0.411 . . . . 2.8500000000000001 110.622 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.2 p -164.19 -27.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.991 -0.55 . . . . 0.33000000000000002 111.097 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . 0.559 ' CE3' HG13 ' A' ' 785' ' ' VAL . 38.3 m0 -53.23 126.01 19.54 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.092 -0.504 . . . . 0.29999999999999999 112.14 -179.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.13 170.11 9.76 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.626 -0.879 . . . . 1.8899999999999999 108.626 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.425 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 49.8 t80 -56.15 -25.27 45.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.97 0.414 . . . . 0.63 110.161 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 796' ' ' MET . 26.2 t70 -72.6 -59.82 2.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.912 -0.585 . . . . 2.0499999999999998 109.933 178.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.29 -32.68 64.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.284 -0.416 . . . . 1.0700000000000001 110.125 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.599 HD22 ' CE2' ' A' ' 834' ' ' TRP . 22.3 tp -64.31 -53.38 49.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.951 -0.568 . . . . 0.93000000000000005 110.789 179.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.694 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 17.4 mm -56.34 -30.81 31.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.768 -0.651 . . . . 0.32000000000000001 111.689 -179.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 2.6 mtt -68.85 -56.31 8.36 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.234 -0.186 . . . . 1.53 110.964 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -52.03 -51.36 57.95 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.232 0.539 . . . . 0.38 110.131 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.511 ' O ' HG12 ' A' ' 802' ' ' ILE . 79.5 mt -58.76 -52.78 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-N 115.505 -0.77 . . . . 0.5 110.797 179.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.694 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t-20 -50.49 -31.73 16.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.801 -0.636 . . . . 0.81000000000000005 111.536 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.54 -34.19 67.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.441 -0.345 . . . . 0.97999999999999998 110.802 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.54 8.49 44.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 2.25 111.99 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.568 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 3.3 pt -129.14 -19.1 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 111.824 0.305 . . . . 0.75 111.824 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.577 -0.283 . . . . 1.53 111.044 -179.948 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . 0.413 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 35.1 Cg_exo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.856 0.274 . . . . 0.94999999999999996 112.32 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 1.9 mt -109.48 159.58 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 1.9399999999999999 110.8 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 9.5 p -126.42 -51.17 1.51 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.433 -0.348 . . . . 1.1599999999999999 111.611 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.67 125.68 29.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.9 0.381 . . . . 2.6899999999999999 111.033 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.5 pp -146.59 160.63 10.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.83999999999999997 111.339 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.47 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 16.5 mmtt -102.51 164.12 11.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.995 -0.548 . . . . 0.84999999999999998 110.52 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.556 ' CE1' HG23 ' A' ' 826' ' ' VAL . 12.2 p90 -145.77 153.4 40.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.948 0.404 . . . . 0.70999999999999996 111.312 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . 0.471 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.6 OUTLIER -76.72 104.76 7.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.924 -0.58 . . . . 1.9099999999999999 110.751 -179.611 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.537 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.8 t70 -79.26 173.98 12.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.581 -0.736 . . . . 1.8 111.055 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . 0.454 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 6.7 pt-20 -74.1 9.42 1.6 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.14 -0.482 . . . . 1.6200000000000001 111.446 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.72 14.47 29.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.386 -0.37 . . . . 1.6499999999999999 110.802 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 59.07 46.93 93.01 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.751 -0.738 . . . . 0.88 112.376 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -174.5 136.43 0.45 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.025 0.44 . . . . 1.8600000000000001 110.546 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.474 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 91.6 m-85 -63.21 140.7 58.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.751 -0.659 . . . . 0.64000000000000001 110.915 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.556 HG23 ' CE1' ' A' ' 818' ' ' TYR . 2.4 m -130.36 -179.6 3.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.082 -0.508 . . . . 0.96999999999999997 110.648 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.85 112.7 31.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.05 0.452 . . . . 0.56000000000000005 111.388 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.405 ' HB2' ' CD1' ' A' ' 818' ' ' TYR . 0.7 OUTLIER -81.52 123.89 29.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.81000000000000005 110.856 179.892 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -63.5 -65.74 2.91 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.806 -0.711 . . . . 0.81000000000000005 112.443 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . 0.423 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 2.1 p -173.97 -131.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.241 -0.281 . . . . 1.3100000000000001 110.241 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.423 ' H ' ' HB2' ' A' ' 830' ' ' SER . 4.8 p-10 -64.03 -14.24 52.82 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.811 0.338 . . . . 2.2000000000000002 110.743 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.571 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.0 OUTLIER -74.34 -69.84 0.43 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.141 -0.482 . . . . 2.21 110.697 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . 0.404 ' HB2' ' HG ' ' A' ' 828' ' ' LEU . 3.7 m-20 -59.69 -14.53 14.43 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.149 -0.478 . . . . 0.72999999999999998 110.395 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.72 ' HZ2' HG11 ' A' ' 785' ' ' VAL . 1.3 t-105 -81.18 -43.54 19.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.127 -0.488 . . . . 0.26000000000000001 110.094 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.756 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -67.3 -35.93 80.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.025 -0.534 . . . . 1.98 109.78 178.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 832' ' ' GLU . 21.8 t -71.22 -55.74 12.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.398 -0.819 . . . . 0.67000000000000004 110.274 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.75 -24.15 55.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.005 -0.543 . . . . 0.22 110.591 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.756 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 31.5 mtmt -71.95 -42.26 66.8 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.163 -0.471 . . . . 0.84999999999999998 110.293 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -65.45 -27.63 68.65 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.103 -0.498 . . . . 1.95 110.014 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . 0.454 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 12.4 ttp -72.27 -35.13 68.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.743 -0.662 . . . . 0.29999999999999999 110.343 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.713 HD11 HD23 ' A' ' 849' ' ' LEU . 50.4 mt -70.47 -51.97 25.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.816 -0.629 . . . . 0.46999999999999997 110.811 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.42 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -75.69 -0.63 21.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.48999999999999999 111.359 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -65.85 -0.75 2.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.992 0.425 . . . . 1.6799999999999999 110.299 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 842' ' ' ALA . 69.8 m-80 -150.67 -71.39 0.17 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.852 -0.613 . . . . 1.96 110.507 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.38 27.18 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.885 -0.598 . . . . 1.99 111.0 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' A' ' 841' ' ' LEU . 4.5 mt-10 -87.61 156.29 19.56 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.87 0.367 . . . . 2.2999999999999998 111.038 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -145.85 -29.07 0.42 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.039 -0.528 . . . . 1.98 110.956 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.442 ' CE1' HD12 ' A' ' 784' ' ' LEU . 36.6 m-85 -79.8 157.29 27.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.183 -0.462 . . . . 1.0900000000000001 110.922 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.713 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -141.24 126.48 18.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.73999999999999999 110.852 179.815 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.614 ' ND2' HG23 ' A' ' 782' ' ' THR . 13.9 m120 -77.47 161.2 28.13 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.362 -0.381 . . . . 1.52 111.171 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.812 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-N 116.346 -0.388 . . . . 1.04 111.527 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.421 HG22 ' H ' ' A' ' 851' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.707 0.289 . . . . 1.22 110.973 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.706 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.68 91.11 1.28 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.05 0.452 . . . . 0.93999999999999995 110.113 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.478 HG23 ' CG ' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -98.33 92.89 5.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 0.67000000000000004 111.106 -179.414 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.64 157.77 17.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.688 -0.687 . . . . 1.5700000000000001 110.746 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.75 112.78 23.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.417 -0.356 . . . . 0.81000000000000005 110.381 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.643 HG11 ' CZ2' ' A' ' 834' ' ' TRP . 23.5 t -107.6 153.63 8.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.035 -0.53 . . . . 1.1799999999999999 111.515 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.406 ' N ' HG12 ' A' ' 785' ' ' VAL . 0.2 OUTLIER -104.82 175.37 5.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.883 -0.598 . . . . 1.3999999999999999 110.453 179.509 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -90.0 55.63 3.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.991 0.424 . . . . 2.8500000000000001 110.734 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.5 p -168.07 -26.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.052 -0.522 . . . . 0.33000000000000002 111.156 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . 0.575 ' CE3' HG13 ' A' ' 785' ' ' VAL . 36.1 m0 -52.42 125.42 16.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.29999999999999999 111.767 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.68 169.78 10.23 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.808 -0.812 . . . . 1.8899999999999999 108.808 178.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.448 ' O ' HG12 ' A' ' 795' ' ' ILE . 10.1 t80 -55.62 -25.02 36.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.984 0.421 . . . . 0.63 109.912 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.593 ' O ' ' HG3' ' A' ' 796' ' ' MET . 4.6 m-20 -73.22 -61.18 1.91 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.896 -0.593 . . . . 2.0499999999999998 109.679 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.94 -32.05 60.97 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 116.229 -0.441 . . . . 1.0700000000000001 110.321 179.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.569 HD22 ' CE2' ' A' ' 834' ' ' TRP . 23.2 tp -64.42 -52.78 56.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.814 -0.63 . . . . 0.93000000000000005 110.506 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.663 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 21.2 mm -59.55 -30.83 45.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.697 -0.683 . . . . 0.32000000000000001 111.571 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.593 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 3.2 mtt -68.56 -53.76 20.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.61 0.243 . . . . 1.53 110.736 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.09 -49.57 66.17 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.082 0.467 . . . . 0.38 110.285 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.409 HG22 HG12 ' A' ' 802' ' ' ILE . 56.5 mt -60.83 -52.84 56.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.623 -0.717 . . . . 0.5 110.546 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.663 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -51.81 -23.71 5.07 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.604 -0.725 . . . . 0.81000000000000005 111.548 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.46 -33.8 31.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.384 -0.371 . . . . 0.97999999999999998 110.676 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -94.81 4.17 54.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.061 -0.518 . . . . 2.25 111.454 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.576 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.1 pt -124.6 -35.04 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 111.725 0.269 . . . . 0.75 111.725 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . 0.467 ' N ' HG13 ' A' ' 802' ' ' ILE . 23.0 p . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.946 0.403 . . . . 1.53 111.071 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 C--O 1.23 0.124 0 CA-C-O 120.794 0.247 . . . . 0.94999999999999996 112.02 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 2.8 pt -147.79 139.07 17.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.309 -0.405 . . . . 1.9399999999999999 111.326 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 72.0 p -114.18 -46.32 3.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 1.1599999999999999 111.078 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -99.1 127.28 45.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 2.6899999999999999 110.861 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.1 pp -153.82 171.51 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.173 -0.467 . . . . 0.83999999999999997 111.229 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -101.49 175.07 5.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.84999999999999998 110.821 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.662 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 27.5 p90 -145.6 156.75 43.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.225 -0.443 . . . . 0.70999999999999996 111.08 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . 0.523 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.8 OUTLIER -86.93 106.49 17.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.228 0.537 . . . . 1.9099999999999999 110.59 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -79.4 177.76 8.61 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.426 -0.806 . . . . 1.8 110.886 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . 0.507 ' HG2' ' HG3' ' A' ' 840' ' ' MET . 0.2 OUTLIER -80.69 13.2 2.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.121 -0.49 . . . . 1.6200000000000001 111.088 -179.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -99.75 -11.82 20.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 1.6499999999999999 110.743 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 94.39 11.36 57.28 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.705 -0.759 . . . . 0.88 112.618 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -128.5 -153.49 0.57 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.997 0.427 . . . . 1.8600000000000001 110.612 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.475 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 63.0 m-85 -133.26 134.94 44.58 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.918 -0.583 . . . . 0.64000000000000001 111.195 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.662 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 1.5 t -111.32 173.18 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 116.052 -0.522 . . . . 0.96999999999999997 110.946 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . 0.586 ' H ' HG12 ' A' ' 826' ' ' VAL . 6.1 t -99.45 107.06 19.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.797 0.332 . . . . 0.56000000000000005 111.074 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 7.5 tp -79.76 104.92 10.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.81000000000000005 110.672 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.11 -63.66 3.68 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.831 -0.7 . . . . 0.81000000000000005 112.712 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . 0.521 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -166.64 -142.45 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.465 0.174 . . . . 1.3100000000000001 110.571 -179.795 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.521 ' H ' ' HB3' ' A' ' 830' ' ' SER . 4.6 t0 -59.66 -14.1 12.45 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.739 0.304 . . . . 2.2000000000000002 110.925 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.405 ' O ' HG23 ' A' ' 836' ' ' VAL . 2.9 mt-10 -73.8 -70.88 0.35 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.289 -0.414 . . . . 2.21 110.733 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -63.31 -11.91 25.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.72999999999999998 110.357 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.643 ' CZ2' HG11 ' A' ' 785' ' ' VAL . 1.5 t-105 -83.1 -39.69 20.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.18 -0.464 . . . . 0.26000000000000001 109.898 179.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.719 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -69.9 -36.36 75.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.893 -0.594 . . . . 1.98 109.936 178.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 832' ' ' GLU . 44.2 t -72.01 -54.54 16.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.419 -0.81 . . . . 0.67000000000000004 110.296 179.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.39 -24.85 61.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.099 -0.501 . . . . 0.22 110.462 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.719 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.0 mtmt -69.77 -43.46 72.16 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.101 -0.5 . . . . 0.84999999999999998 110.367 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -64.41 -26.21 68.36 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 1.95 110.031 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . 0.507 ' HG3' ' HG2' ' A' ' 821' ' ' GLU . 7.6 ttp -72.92 -36.5 67.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.667 -0.697 . . . . 0.29999999999999999 110.155 179.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.592 HD11 HD23 ' A' ' 849' ' ' LEU . 3.2 mt -68.59 -44.28 74.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.585 . . . . 0.46999999999999997 110.773 179.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.423 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.46 -23.51 66.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.48999999999999999 111.179 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.8 3.81 1.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 1.6799999999999999 110.591 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 842' ' ' ALA . 38.6 m-80 -151.31 16.69 0.73 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.968 -0.56 . . . . 1.96 110.692 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 24.0 t30 58.59 19.68 6.91 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.01 -0.541 . . . . 1.99 111.102 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.16 161.06 29.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 2.2999999999999998 111.024 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -152.54 10.25 0.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 1.98 110.696 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.416 ' HB3' HG22 ' A' ' 782' ' ' THR . 74.6 m-85 -112.97 125.91 54.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.957 -0.565 . . . . 1.0900000000000001 110.765 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.592 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -122.06 119.08 30.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.73999999999999999 111.002 -179.688 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.523 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 6.5 m120 -82.17 174.68 10.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 1.52 111.178 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.706 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.6 mm . . . . . 0 C--N 1.333 -0.145 0 CA-C-N 116.165 -0.471 . . . . 1.04 111.167 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.757 0.313 . . . . 1.22 110.978 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.774 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -144.21 84.15 1.75 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.254 -0.43 . . . . 0.93999999999999995 109.971 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.524 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.3 OUTLIER -98.5 102.64 14.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.67000000000000004 111.602 -179.258 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.54 -164.87 1.19 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.009 -0.541 . . . . 1.5700000000000001 110.342 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.412 HD12 ' CE1' ' A' ' 848' ' ' PHE . 0.6 OUTLIER -119.04 108.83 15.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.012 0.434 . . . . 0.81000000000000005 110.151 179.325 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.476 HG13 ' CE3' ' A' ' 789' ' ' TRP . 90.3 t -101.88 147.11 9.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.664 -0.698 . . . . 1.1799999999999999 111.155 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -103.98 168.84 8.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.257 -0.429 . . . . 1.3999999999999999 110.953 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.82 56.53 3.93 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.193 0.52 . . . . 2.8500000000000001 110.488 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 1.7 p -164.32 -27.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.515 -0.766 . . . . 0.33000000000000002 110.49 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . 0.476 ' CE3' HG13 ' A' ' 785' ' ' VAL . 30.3 m0 -50.52 124.25 10.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.498 -0.774 . . . . 0.29999999999999999 111.897 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . 0.75 HD21 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -93.43 162.62 13.91 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.916 -0.772 . . . . 1.8899999999999999 108.916 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -44.04 -30.18 0.7 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.824 0.345 . . . . 0.63 111.395 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.75 ' HB3' HD21 ' A' ' 790' ' ' ASN . 13.1 t0 -76.69 -59.01 2.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.233 -0.44 . . . . 2.0499999999999998 110.143 179.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . 0.631 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 1.4 m-20 -53.12 -21.69 5.21 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.553 0.692 . . . . 1.0700000000000001 109.271 178.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.443 HD13 ' N ' ' A' ' 795' ' ' ILE . 1.3 tm? -74.19 -75.58 0.15 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.766 -1.106 . . . . 0.93000000000000005 109.988 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.631 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 23.4 mm -46.44 -32.38 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.032 -0.985 . . . . 0.32000000000000001 111.98 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.624 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 26.1 mtm -69.93 -42.23 73.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.711 0.291 . . . . 1.53 110.836 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -63.73 -47.68 80.09 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.012 0.434 . . . . 0.38 110.101 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 802' ' ' ILE . 31.2 mt -62.74 -50.23 80.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.711 -0.677 . . . . 0.5 110.176 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.659 HD21 ' H ' ' A' ' 813' ' ' ILE . 1.2 t-20 -52.19 -32.63 37.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.6 -0.727 . . . . 0.81000000000000005 111.242 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.87 -32.69 65.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.97999999999999998 110.79 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . 0.457 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 4.4 mmtt -88.05 -5.06 58.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.093 -0.503 . . . . 2.25 111.374 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.631 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.3 pp -111.79 -21.65 5.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.498 -0.319 . . . . 0.75 111.423 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.342 -0.39 . . . . 1.53 111.085 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo . . . . . 0 C--O 1.231 0.156 0 CA-C-O 120.87 0.279 . . . . 0.94999999999999996 112.392 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.659 ' H ' HD21 ' A' ' 799' ' ' ASN . 11.6 pt -135.59 -178.22 2.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 1.9399999999999999 111.084 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 8.9 p -142.73 -66.32 0.39 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.093 -0.503 . . . . 1.1599999999999999 111.097 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.03 129.68 34.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.148 -0.478 . . . . 2.6899999999999999 110.66 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.3 pp -146.05 161.53 11.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.065 0.459 . . . . 0.83999999999999997 111.495 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -102.31 160.03 14.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.746 -0.661 . . . . 0.84999999999999998 110.496 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.605 ' CE1' HG23 ' A' ' 826' ' ' VAL . 11.0 p90 -145.31 156.49 43.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.973 0.416 . . . . 0.70999999999999996 111.307 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -78.59 107.01 10.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.832 -0.622 . . . . 1.9099999999999999 110.738 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.418 ' HB2' HG22 ' A' ' 826' ' ' VAL . 2.7 t0 -78.27 176.41 9.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.631 -0.713 . . . . 1.8 110.578 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -76.04 4.76 7.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.438 . . . . 1.6200000000000001 111.409 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -102.65 16.01 27.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.408 -0.36 . . . . 1.6499999999999999 110.833 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 57.73 50.56 64.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.822 -0.704 . . . . 0.88 112.358 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -173.1 132.89 0.51 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.794 0.331 . . . . 1.8600000000000001 110.635 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.475 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 71.6 m-85 -61.03 142.55 56.54 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.097 -0.501 . . . . 0.64000000000000001 110.682 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.605 HG23 ' CE1' ' A' ' 818' ' ' TYR . 2.4 m -134.66 179.39 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.297 -0.41 . . . . 0.96999999999999997 111.037 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -99.14 113.11 33.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.969 0.414 . . . . 0.56000000000000005 111.371 -179.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.24 120.81 24.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.825 -0.625 . . . . 0.81000000000000005 110.835 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.12 -68.27 1.71 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.844 -0.693 . . . . 0.81000000000000005 112.606 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -170.8 -144.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.485 -0.191 . . . . 1.3100000000000001 110.485 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -53.77 -25.03 17.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.74 0.305 . . . . 2.2000000000000002 111.081 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.502 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.1 OUTLIER -66.65 -66.59 0.53 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.233 -0.439 . . . . 2.21 110.656 179.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.22 -12.14 37.89 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.277 -0.42 . . . . 0.72999999999999998 110.348 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.467 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 3.6 t-105 -81.88 -40.02 23.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.26000000000000001 109.808 178.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.698 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 11.6 m-80 -71.02 -32.04 68.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 1.98 109.883 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 832' ' ' GLU . 39.7 t -75.34 -53.77 15.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.715 -0.675 . . . . 0.67000000000000004 109.818 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -56.33 -28.11 57.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.996 -0.547 . . . . 0.22 110.315 179.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.698 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.1 mtmt -71.86 -48.41 46.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.854 -0.612 . . . . 0.84999999999999998 110.267 179.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.12 -22.49 66.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.944 -0.571 . . . . 1.95 110.104 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 1.2 ttp -77.54 -35.16 53.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.811 -0.631 . . . . 0.29999999999999999 110.266 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.772 HD11 HD23 ' A' ' 849' ' ' LEU . 10.2 mt -66.33 -48.86 68.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.917 -0.583 . . . . 0.46999999999999997 110.805 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.443 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.51 -29.69 70.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.414 . . . . 0.48999999999999999 111.017 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -70.63 8.59 0.82 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.984 -0.553 . . . . 1.6799999999999999 110.792 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.443 ' H ' ' C ' ' A' ' 842' ' ' ALA . 40.4 m-80 -148.55 19.63 1.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 1.96 111.005 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 62.77 10.84 4.49 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.206 -0.452 . . . . 1.99 111.064 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . 0.47 ' HB3' HD23 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -86.38 147.1 26.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 2.2999999999999998 110.859 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.45 -18.91 1.45 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 1.98 110.931 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.524 ' HB3' HG22 ' A' ' 782' ' ' THR . 25.2 m-85 -87.96 147.02 25.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.278 -0.419 . . . . 1.0900000000000001 110.764 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.772 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -124.03 133.49 53.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.905 0.384 . . . . 0.73999999999999999 111.321 -179.498 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.457 ' O ' HD13 ' A' ' 849' ' ' LEU . 8.7 m120 -92.48 157.75 16.4 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.989 -0.55 . . . . 1.52 110.747 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.774 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.331 -0.199 0 CA-C-N 116.465 -0.334 . . . . 1.04 111.82 -179.479 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.422 HG23 ' HZ ' ' A' ' 825' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.839 0.352 . . . . 1.22 110.877 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 1.009 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -150.83 89.72 1.56 Allowed 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.594 -0.521 . . . . 0.93999999999999995 109.594 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.1 OUTLIER -97.99 110.6 23.15 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.816 -0.629 . . . . 0.67000000000000004 111.473 -179.013 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.524 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -110.6 -167.67 1.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.801 -0.636 . . . . 1.5700000000000001 110.606 179.765 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.57 109.24 18.67 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.027 -0.533 . . . . 0.81000000000000005 110.194 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.424 HG21 ' HH2' ' A' ' 834' ' ' TRP . 27.9 m -105.79 172.73 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 1.1799999999999999 111.462 -179.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -129.4 158.43 39.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.943 -0.571 . . . . 1.3999999999999999 110.875 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -9.56 51.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 2.8500000000000001 110.959 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.8 p -95.05 -24.97 4.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.884 -0.598 . . . . 0.33000000000000002 110.762 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 27.0 m0 -58.41 124.72 20.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.738 -0.665 . . . . 0.29999999999999999 111.854 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . 0.85 HD21 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -98.06 161.35 13.76 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.916 -0.772 . . . . 1.8899999999999999 108.916 178.394 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.46 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 53.5 t80 -44.36 -33.13 1.54 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.829 0.347 . . . . 0.63 111.138 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.85 ' HB3' HD21 ' A' ' 790' ' ' ASN . 35.7 t70 -69.52 -55.21 10.84 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.669 -0.493 . . . . 2.0499999999999998 109.669 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . 0.631 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.6 OUTLIER -58.74 -23.65 60.26 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.167 0.508 . . . . 1.0700000000000001 110.31 179.124 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.551 HD22 ' CE2' ' A' ' 834' ' ' TRP . 34.5 tp -74.05 -54.35 8.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.62 -0.718 . . . . 0.93000000000000005 110.367 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.68 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 32.0 mm -57.41 -31.45 38.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.593 -0.73 . . . . 0.32000000000000001 111.74 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.681 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 33.4 mtm -68.14 -50.23 56.0 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.965 -0.294 . . . . 1.53 110.417 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.72 -52.64 61.83 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.026 0.441 . . . . 0.38 109.99 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.68 -51.4 72.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.731 -0.668 . . . . 0.5 110.61 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.68 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.7 OUTLIER -57.15 -24.39 53.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.61 -0.723 . . . . 0.81000000000000005 111.199 -179.754 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 34.6 m -79.8 -26.72 40.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.108 -0.496 . . . . 0.97999999999999998 110.644 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . 0.504 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -98.91 -3.97 33.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.092 -0.503 . . . . 2.25 111.19 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.594 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.2 pt -116.69 -25.52 3.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.76 0.314 . . . . 0.75 111.437 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . 0.448 ' N ' HG13 ' A' ' 802' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 1.53 111.134 -179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . 0.426 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 46.3 Cg_exo . . . . . 0 CA--C 1.527 0.171 0 CA-C-O 120.754 0.231 . . . . 0.94999999999999996 112.161 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 1.4 pp -138.77 158.16 30.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.296 -0.411 . . . . 1.9399999999999999 111.277 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 29.7 p -115.68 -46.35 2.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.273 -0.422 . . . . 1.1599999999999999 111.182 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -80.73 139.61 36.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 2.6899999999999999 110.706 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -153.26 175.4 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 121.022 0.439 . . . . 0.83999999999999997 111.452 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -130.88 126.54 36.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.798 -0.637 . . . . 0.84999999999999998 110.188 179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.608 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 9.1 p90 -96.74 165.2 12.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.808 0.337 . . . . 0.70999999999999996 111.057 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . 0.581 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 5.6 tp60 -103.28 113.31 26.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.099 0.475 . . . . 1.9099999999999999 110.576 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -78.96 170.3 16.9 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.556 -0.747 . . . . 1.8 110.941 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.7 9.8 3.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.128 -0.487 . . . . 1.6200000000000001 111.251 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -105.72 6.61 32.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 1.6499999999999999 111.024 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 67.28 57.31 9.5 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.791 -0.719 . . . . 0.88 112.469 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -170.29 131.34 0.96 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.946 0.403 . . . . 1.8600000000000001 110.662 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.422 ' HZ ' HG23 ' A' ' 780' ' ' ILE . 34.3 m-85 -72.21 131.21 42.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.882 -0.599 . . . . 0.64000000000000001 110.942 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.608 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -115.14 166.58 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 115.787 -0.642 . . . . 0.96999999999999997 111.086 -179.64 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.24 103.49 14.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 0.56000000000000005 110.618 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.0 tt -79.5 119.01 21.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.103 -0.499 . . . . 0.81000000000000005 110.916 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -65.58 -66.46 2.42 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.875 -0.678 . . . . 0.81000000000000005 112.775 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . 0.448 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 2.5 m -167.54 -135.16 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 110.463 -0.199 . . . . 1.3100000000000001 110.463 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.448 ' H ' ' HB3' ' A' ' 830' ' ' SER . 1.0 OUTLIER -57.81 -22.46 47.56 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.801 0.334 . . . . 2.2000000000000002 110.941 179.797 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -68.1 -70.05 0.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 2.21 110.877 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.13 -13.91 20.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.35 -0.386 . . . . 0.72999999999999998 110.511 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.551 ' CE2' HD22 ' A' ' 794' ' ' LEU . 0.4 OUTLIER -80.06 -44.96 19.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.969 -0.56 . . . . 0.26000000000000001 109.941 179.249 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.688 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 18.7 m-80 -68.11 -30.19 69.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.08 -0.509 . . . . 1.98 110.061 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 65.1 t -76.39 -56.02 9.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.735 -0.666 . . . . 0.67000000000000004 110.325 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.28 -27.59 64.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.006 -0.543 . . . . 0.22 110.611 179.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.688 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 25.1 mtmt -69.21 -45.27 70.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.183 -0.462 . . . . 0.84999999999999998 110.171 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.99 -26.17 65.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.079 -0.509 . . . . 1.95 110.082 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 19.8 ttp -74.54 -35.32 63.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.632 -0.713 . . . . 0.29999999999999999 110.319 179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.877 HD11 HD23 ' A' ' 849' ' ' LEU . 18.7 mt -66.67 -55.94 12.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.056 -0.52 . . . . 0.46999999999999997 110.646 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -61.44 -20.3 62.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.038 -0.528 . . . . 0.48999999999999999 111.235 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.13 2.21 1.66 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 1.6799999999999999 110.403 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.441 ' H ' ' C ' ' A' ' 842' ' ' ALA . 54.0 m-80 -153.7 23.15 0.52 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.902 -0.59 . . . . 1.96 110.769 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.9 t30 59.24 21.59 9.77 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.076 -0.511 . . . . 1.99 111.036 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -82.85 142.09 31.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 2.2999999999999998 110.867 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 4.05 4.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 1.98 111.044 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.524 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 4.5 m-85 -104.0 126.17 50.92 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.24 -0.436 . . . . 1.0900000000000001 110.94 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.877 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -119.06 127.66 53.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 0.73999999999999999 111.116 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.581 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 17.2 m-20 -86.0 156.21 20.54 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.962 -0.563 . . . . 1.52 110.721 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 1.009 HD12 ' HB3' ' A' ' 781' ' ' PHE . 1.7 mt . . . . . 0 C--N 1.332 -0.158 0 CA-C-O 120.753 0.311 . . . . 1.04 111.835 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.494 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.756 0.313 . . . . 1.22 110.811 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.99 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.4 OUTLIER -151.82 93.92 1.91 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.497 -0.557 . . . . 0.93999999999999995 109.497 179.55 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.762 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.2 OUTLIER -97.89 99.92 11.26 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.608 -0.724 . . . . 0.67000000000000004 111.233 -178.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.492 HD11 ' HE2' ' A' ' 801' ' ' LYS . 0.4 OUTLIER -106.28 140.9 38.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.602 -0.726 . . . . 1.5700000000000001 110.572 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.47 113.77 12.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.076 0.465 . . . . 0.81000000000000005 110.489 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.419 HG11 ' HH2' ' A' ' 834' ' ' TRP . 32.7 m -106.1 -163.92 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.516 -0.766 . . . . 1.1799999999999999 111.152 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.452 ' HG2' HG12 ' A' ' 788' ' ' VAL . 0.2 OUTLIER -150.06 169.14 21.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.219 -0.446 . . . . 1.3999999999999999 111.132 -179.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.33 -10.34 59.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 2.8500000000000001 110.917 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . 0.452 HG12 ' HG2' ' A' ' 786' ' ' GLU . 2.6 p -97.64 -28.02 3.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.921 -0.581 . . . . 0.33000000000000002 110.719 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 21.2 m0 -53.36 119.06 4.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.759 -0.655 . . . . 0.29999999999999999 111.565 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.05 168.22 16.12 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.215 -0.661 . . . . 1.8899999999999999 109.215 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -53.4 -25.51 16.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.931 0.396 . . . . 0.63 110.199 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' A' ' 796' ' ' MET . 47.1 m-20 -79.97 -57.46 3.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.952 -0.567 . . . . 2.0499999999999998 109.688 178.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.01 -21.72 4.82 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.036 -0.727 . . . . 1.0700000000000001 109.036 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.489 HD13 ' N ' ' A' ' 795' ' ' ILE . 1.3 tm? -75.35 -76.44 0.15 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.827 -1.079 . . . . 0.93000000000000005 110.208 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.643 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 16.3 mm -45.52 -35.67 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.162 -0.926 . . . . 0.32000000000000001 112.072 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.634 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 20.7 mtt -67.91 -48.98 64.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.563 0.22 . . . . 1.53 110.715 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -56.55 -52.81 63.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.112 0.482 . . . . 0.38 109.965 179.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.516 ' O ' HG23 ' A' ' 802' ' ' ILE . 76.4 mt -56.93 -52.71 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.553 -0.749 . . . . 0.5 110.527 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.798 ' HA ' HG12 ' A' ' 802' ' ' ILE . 1.6 t-20 -53.2 -34.29 56.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.412 -0.813 . . . . 0.81000000000000005 111.372 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 13.3 t -69.18 -30.47 68.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.337 -0.392 . . . . 0.97999999999999998 110.941 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . 0.492 ' HE2' HD11 ' A' ' 783' ' ' LEU . 10.1 mptt -88.38 -18.42 28.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 2.25 111.42 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.798 HG12 ' HA ' ' A' ' 799' ' ' ASN . 0.9 OUTLIER -94.8 -23.84 5.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.716 0.293 . . . . 0.75 111.355 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . 0.42 ' N ' HG13 ' A' ' 802' ' ' ILE . 94.9 p . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.345 -0.389 . . . . 1.53 110.9 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . 0.483 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 31.2 Cg_exo . . . . . 0 CA--C 1.528 0.19 0 CA-C-O 120.779 0.241 . . . . 0.94999999999999996 112.456 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.405 HG12 HD13 ' A' ' 802' ' ' ILE . 14.3 mm -115.7 153.91 17.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.123 -0.49 . . . . 1.9399999999999999 110.904 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -124.08 -68.67 0.85 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.437 -0.347 . . . . 1.1599999999999999 111.462 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.78 129.77 34.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.309 -0.405 . . . . 2.6899999999999999 110.794 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.5 pp -144.75 -178.22 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.211 -0.45 . . . . 0.83999999999999997 111.409 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.459 ' O ' ' HA ' ' A' ' 851' ' ' ILE . 15.6 mmtt -121.79 149.92 42.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.983 -0.553 . . . . 0.84999999999999998 110.488 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 0.9 OUTLIER -130.98 165.05 24.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.364 . . . . 0.70999999999999996 111.299 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.05 109.13 21.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.947 -0.57 . . . . 1.9099999999999999 111.086 -179.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -79.12 167.31 21.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.566 -0.743 . . . . 1.8 110.53 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -70.06 -0.0 6.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.351 -0.386 . . . . 1.6200000000000001 111.443 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.68 13.61 33.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.446 -0.343 . . . . 1.6499999999999999 110.94 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 57.56 57.84 17.71 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.754 -0.736 . . . . 0.88 112.167 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -169.2 131.29 1.2 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 1.8600000000000001 110.708 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.496 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 57.9 m-85 -75.19 134.92 41.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.916 -0.584 . . . . 0.64000000000000001 110.974 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . . . . . . . . . 11.7 m -128.26 -177.91 2.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.96999999999999997 110.69 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 2.0 t -99.08 103.41 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.025 0.441 . . . . 0.56000000000000005 111.74 -179.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.478 ' HG ' ' HB3' ' A' ' 833' ' ' ASP . 8.7 tt -107.54 137.64 45.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.764 -0.653 . . . . 0.81000000000000005 110.379 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -179.76 32.92 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.269 -0.967 . . . . 0.81000000000000005 113.148 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.47 150.68 30.67 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.877 0.339 . . . . 1.3100000000000001 110.529 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -51.55 -21.93 2.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.014 0.435 . . . . 2.2000000000000002 110.386 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.52 ' O ' HG23 ' A' ' 836' ' ' VAL . 27.5 tt0 -71.6 -61.76 1.66 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.585 . . . . 2.21 110.967 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . 0.478 ' HB3' ' HG ' ' A' ' 828' ' ' LEU . 0.6 OUTLIER -63.45 -17.94 63.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.812 0.339 . . . . 0.72999999999999998 110.157 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.522 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.8 t-105 -82.4 -42.11 19.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.142 -0.481 . . . . 0.26000000000000001 110.425 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.753 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 16.6 m-80 -71.0 -30.87 67.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.098 0.475 . . . . 1.98 110.185 179.18 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 832' ' ' GLU . 91.2 t -75.74 -53.55 15.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.838 -0.619 . . . . 0.67000000000000004 110.011 179.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.84 -26.12 61.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.057 -0.519 . . . . 0.22 110.492 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.753 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 34.3 mtmt -72.46 -42.71 64.67 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.191 -0.459 . . . . 0.84999999999999998 110.32 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -64.38 -26.39 68.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.963 -0.562 . . . . 1.95 110.305 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 9.3 ttp -74.76 -39.26 61.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.791 -0.64 . . . . 0.29999999999999999 110.443 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.677 HD11 HD23 ' A' ' 849' ' ' LEU . 63.4 mt -64.49 -42.72 95.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.46999999999999997 110.845 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.0 -28.66 69.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.223 -0.444 . . . . 0.48999999999999999 111.074 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -70.61 6.94 1.23 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 1.6799999999999999 110.58 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.434 ' H ' ' C ' ' A' ' 842' ' ' ALA . 37.0 m-80 -148.1 14.76 1.03 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.042 -0.526 . . . . 1.96 110.911 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 59.19 18.22 6.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 1.99 111.14 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . 0.47 ' HB3' HD22 ' A' ' 841' ' ' LEU . 1.7 mm-40 -79.27 169.88 17.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.34 -0.391 . . . . 2.2999999999999998 110.936 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.8 10.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 1.98 111.195 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.762 ' HB3' HG22 ' A' ' 782' ' ' THR . 49.9 m-85 -117.23 131.68 56.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.821 0.343 . . . . 1.0900000000000001 110.629 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.677 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -110.5 123.74 50.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.73999999999999999 111.027 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -83.15 141.35 32.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.125 -0.489 . . . . 1.52 110.949 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.99 HD12 ' HB3' ' A' ' 781' ' ' PHE . 1.2 mt . . . . . 0 C--N 1.333 -0.11 0 CA-C-N 116.498 -0.319 . . . . 1.04 111.821 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.745 0.307 . . . . 1.22 111.053 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 1.082 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -149.0 89.44 1.67 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.509 -0.552 . . . . 0.93999999999999995 109.509 179.778 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.56 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -97.53 102.2 13.9 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.911 -0.586 . . . . 0.67000000000000004 111.341 -178.889 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.54 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 8.9 mp -89.48 -176.37 5.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.544 -0.753 . . . . 1.5700000000000001 110.637 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.77 95.04 5.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.829 -0.623 . . . . 0.81000000000000005 109.523 178.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.59 HG11 ' CZ2' ' A' ' 834' ' ' TRP . 93.8 t -92.76 146.52 6.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.347 -0.842 . . . . 1.1799999999999999 111.683 -178.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.405 ' HB3' HG12 ' A' ' 788' ' ' VAL . 0.1 OUTLIER -102.41 171.04 7.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.817 -0.629 . . . . 1.3999999999999999 110.629 179.688 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.32 53.55 2.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 2.8500000000000001 110.858 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . 0.405 HG12 ' HB3' ' A' ' 786' ' ' GLU . 2.7 p -163.35 -22.97 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.981 -0.554 . . . . 0.33000000000000002 110.87 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 36.6 m0 -57.07 129.55 42.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.766 -0.652 . . . . 0.29999999999999999 112.118 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.16 166.9 11.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.707 -0.849 . . . . 1.8899999999999999 108.707 178.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -54.58 -23.36 16.51 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.746 -0.382 . . . . 0.63 110.076 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.594 ' O ' ' HG3' ' A' ' 796' ' ' MET . 10.0 t70 -73.24 -58.36 3.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.912 -0.585 . . . . 2.0499999999999998 109.919 178.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.39 -33.47 69.66 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 116.265 -0.425 . . . . 1.0700000000000001 110.334 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.536 HD22 ' CE2' ' A' ' 834' ' ' TRP . 24.7 tp -61.56 -51.74 67.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.832 -0.622 . . . . 0.93000000000000005 110.07 179.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.696 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 17.8 mm -57.76 -31.47 40.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.54 -0.755 . . . . 0.32000000000000001 111.252 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.594 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.4 mtp -67.4 -52.19 42.82 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.7 0.286 . . . . 1.53 110.504 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.5 -53.51 50.5 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.172 -0.467 . . . . 0.38 110.241 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.458 ' O ' HG23 ' A' ' 802' ' ' ILE . 70.3 mt -58.76 -50.16 80.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.772 -0.649 . . . . 0.5 110.768 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.696 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.1 t-20 -55.59 -27.91 52.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.702 -0.681 . . . . 0.81000000000000005 111.248 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 46.9 t -78.62 -26.14 45.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.354 -0.385 . . . . 0.97999999999999998 110.743 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . 0.502 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -97.65 -2.03 42.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 2.25 111.298 -179.824 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.729 HD13 HG12 ' A' ' 813' ' ' ILE . 1.0 OUTLIER -113.89 -34.2 2.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.733 0.301 . . . . 0.75 111.399 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . 0.5 ' N ' HG13 ' A' ' 802' ' ' ILE . 14.7 p . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 1.53 111.159 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo . . . . . 0 C--O 1.231 0.152 0 CA-C-O 120.786 0.244 . . . . 0.94999999999999996 112.011 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.729 HG12 HD13 ' A' ' 802' ' ' ILE . 7.5 pt -132.86 -175.96 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 1.9399999999999999 111.148 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.84 -67.43 0.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.416 -0.357 . . . . 1.1599999999999999 111.465 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -79.58 119.36 22.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.421 -0.354 . . . . 2.6899999999999999 110.852 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . 0.618 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -133.81 177.4 7.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.071 0.463 . . . . 0.83999999999999997 111.562 -179.591 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 15.1 mmtt -115.47 166.64 11.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.668 -0.696 . . . . 0.84999999999999998 110.111 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.593 ' CE1' HG23 ' A' ' 826' ' ' VAL . 9.3 p90 -151.58 157.98 42.91 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.042 0.449 . . . . 0.70999999999999996 111.459 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . 0.557 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 1.6 tt0 -82.78 107.13 15.18 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.819 -0.628 . . . . 1.9099999999999999 110.733 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.415 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 12.8 t0 -78.69 178.17 8.07 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.6 -0.727 . . . . 1.8 110.67 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.28 35.49 0.33 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.412 -0.358 . . . . 1.6200000000000001 111.155 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.66 11.96 4.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 1.6499999999999999 110.608 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . 0.502 ' HA2' HE21 ' A' ' 819' ' ' GLN . . . 61.5 47.34 91.22 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.822 -0.704 . . . . 0.88 112.219 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -171.12 133.97 0.9 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.991 0.424 . . . . 1.8600000000000001 110.615 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.489 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 95.2 m-85 -64.12 145.21 56.32 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.891 -0.595 . . . . 0.64000000000000001 110.784 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.593 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.5 OUTLIER -132.97 177.5 7.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 0.96999999999999997 110.682 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -99.03 110.39 26.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.886 0.374 . . . . 0.56000000000000005 111.181 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.561 HD12 ' HB3' ' A' ' 833' ' ' ASP . 6.0 tp -79.93 113.84 18.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.904 -0.589 . . . . 0.81000000000000005 110.625 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -59.76 -68.88 1.47 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.934 -0.651 . . . . 0.81000000000000005 112.594 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . 0.482 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.3 OUTLIER -171.41 -142.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.475 0.178 . . . . 1.3100000000000001 110.538 -179.834 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.482 ' H ' ' HB3' ' A' ' 830' ' ' SER . 10.3 t70 -55.18 -22.61 18.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.69 0.281 . . . . 2.2000000000000002 110.943 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . 0.576 ' O ' HG23 ' A' ' 836' ' ' VAL . 49.2 mt-10 -68.41 -70.85 0.24 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.383 -0.372 . . . . 2.21 110.737 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . 0.561 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.6 OUTLIER -60.0 -13.34 10.92 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.385 -0.37 . . . . 0.72999999999999998 110.584 179.563 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.59 ' CZ2' HG11 ' A' ' 785' ' ' VAL . 1.0 OUTLIER -79.86 -45.3 18.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.243 -0.435 . . . . 0.26000000000000001 110.014 179.172 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -67.94 -33.28 74.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.924 -0.58 . . . . 1.98 110.224 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 832' ' ' GLU . 15.7 t -73.92 -52.0 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-N 115.887 -0.597 . . . . 0.67000000000000004 109.879 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.97 -26.77 62.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.97 -0.559 . . . . 0.22 110.139 178.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.506 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 0.9 OUTLIER -67.79 -45.97 73.27 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.869 -0.605 . . . . 0.84999999999999998 110.348 179.513 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 0.0 OUTLIER -62.51 -27.76 69.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.1 -0.5 . . . . 1.95 110.225 179.486 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 10.3 ttp -72.21 -36.69 69.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.873 -0.603 . . . . 0.29999999999999999 110.419 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.685 HD11 HD23 ' A' ' 849' ' ' LEU . 3.5 mt -73.92 -47.67 36.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.84 -0.618 . . . . 0.46999999999999997 110.833 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.429 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -63.21 -24.45 67.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.065 -0.516 . . . . 0.48999999999999999 111.047 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 14.9 tt0 -65.64 -0.02 1.88 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 1.6799999999999999 110.46 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.429 ' H ' ' C ' ' A' ' 842' ' ' ALA . 9.7 m120 -145.67 17.82 1.47 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.916 -0.584 . . . . 1.96 110.681 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 4.0 m120 59.05 29.79 19.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.5 . . . . 1.99 110.887 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -84.34 156.82 21.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 2.2999999999999998 110.831 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -149.13 13.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 1.98 110.995 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.54 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 79.9 m-85 -116.46 116.19 27.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 1.0900000000000001 110.765 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.685 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -109.44 125.94 52.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.49 . . . . 0.73999999999999999 111.246 -179.615 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.557 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 9.6 m-20 -79.69 160.64 26.21 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.91 -0.587 . . . . 1.52 111.062 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 1.082 HD12 ' HB3' ' A' ' 781' ' ' PHE . 17.7 mt . . . . . 0 C--N 1.333 -0.119 0 CA-C-N 116.49 -0.323 . . . . 1.04 111.628 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.494 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.856 0.36 . . . . 1.22 111.101 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 0.542 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -149.06 87.02 1.52 Allowed 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.272 -0.422 . . . . 0.93999999999999995 110.194 179.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -98.58 109.93 22.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.872 -0.604 . . . . 0.67000000000000004 111.31 -179.416 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -115.47 -167.99 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.861 -0.609 . . . . 1.5700000000000001 110.726 179.862 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.6 104.28 10.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.956 -0.566 . . . . 0.81000000000000005 110.161 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 34.7 m -96.7 175.58 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.035 -0.53 . . . . 1.1799999999999999 111.206 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.66 162.68 26.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.066 -0.516 . . . . 1.3999999999999999 110.764 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.69 2.95 10.67 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.291 -0.413 . . . . 2.8500000000000001 110.889 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.3 p -109.71 -22.9 4.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.521 . . . . 0.33000000000000002 110.689 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -59.17 123.64 17.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.77 -0.65 . . . . 0.29999999999999999 111.902 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . 0.731 HD21 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -96.49 159.76 14.76 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.854 -0.795 . . . . 1.8899999999999999 108.854 178.188 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.422 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 52.0 t80 -42.68 -34.6 0.93 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.646 0.26 . . . . 0.63 111.29 -178.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.731 ' HB3' HD21 ' A' ' 790' ' ' ASN . 3.7 t0 -68.85 -55.78 10.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.835 -0.432 . . . . 2.0499999999999998 109.835 178.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . 0.595 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 1.0 OUTLIER -56.08 -25.4 45.29 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.218 0.532 . . . . 1.0700000000000001 109.961 179.078 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.575 HD22 ' CE2' ' A' ' 834' ' ' TRP . 37.0 tp -71.93 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.396 -0.82 . . . . 0.93000000000000005 110.241 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.658 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 42.2 mm -55.46 -28.17 22.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.565 -0.743 . . . . 0.32000000000000001 111.541 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.612 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 14.6 mtp -68.26 -50.95 50.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.652 0.263 . . . . 1.53 110.45 179.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -55.52 -53.46 56.15 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.026 0.441 . . . . 0.38 110.041 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 64.3 mt -56.75 -49.74 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.807 -0.633 . . . . 0.5 110.557 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.658 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -54.66 -28.26 45.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.7 -0.682 . . . . 0.81000000000000005 111.273 -179.724 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 35.9 t -78.32 -27.1 47.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.41 -0.359 . . . . 0.97999999999999998 110.985 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -99.29 0.87 43.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 2.25 111.439 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.595 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.7 pp -117.34 -32.14 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.696 0.284 . . . . 0.75 111.397 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 64.0 p . . . . . 0 C--N 1.329 -0.285 0 CA-C-O 120.922 0.391 . . . . 1.53 110.981 -179.721 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 C--O 1.232 0.198 0 CA-C-O 120.738 0.224 . . . . 0.94999999999999996 112.426 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.754 HD13 ' H ' ' A' ' 813' ' ' ILE . 0.2 OUTLIER -114.02 172.94 3.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 1.9399999999999999 111.079 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 31.2 p -126.85 -48.44 1.5 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 1.1599999999999999 111.158 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.5 mptt -80.69 132.05 35.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 2.6899999999999999 110.772 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.1 pp -147.33 174.19 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.43 . . . . 0.83999999999999997 111.166 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.456 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 16.1 mmtt -120.44 145.33 47.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.038 -0.528 . . . . 0.84999999999999998 110.752 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.607 ' CE1' HG23 ' A' ' 826' ' ' VAL . 6.0 p90 -124.72 168.54 13.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.70999999999999996 110.996 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -91.38 107.76 19.42 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.042 -0.526 . . . . 1.9099999999999999 110.798 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . 0.41 ' HB2' HG22 ' A' ' 826' ' ' VAL . 3.9 t70 -78.73 168.87 19.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.691 -0.686 . . . . 1.8 110.641 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . 0.405 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.6 OUTLIER -71.48 4.24 3.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.243 -0.435 . . . . 1.6200000000000001 111.361 -179.626 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -99.88 17.0 21.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.398 -0.365 . . . . 1.6499999999999999 110.742 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 55.9 50.51 60.83 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.848 -0.691 . . . . 0.88 112.333 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -172.97 134.6 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.928 0.394 . . . . 1.8600000000000001 110.454 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.548 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 69.3 m-85 -65.76 140.01 58.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.022 -0.536 . . . . 0.64000000000000001 110.666 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.607 HG23 ' CE1' ' A' ' 818' ' ' TYR . 3.1 m -132.48 177.24 7.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 0.96999999999999997 110.589 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.67 116.17 40.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.049 0.452 . . . . 0.56000000000000005 111.447 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.55 HD12 ' HB3' ' A' ' 833' ' ' ASP . 3.7 tp -79.76 108.05 13.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.682 -0.69 . . . . 0.81000000000000005 110.631 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -53.22 -67.14 2.28 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.928 -0.653 . . . . 0.81000000000000005 112.705 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . 0.448 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 5.7 p -170.93 -141.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.488 -0.19 . . . . 1.3100000000000001 110.488 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.448 ' H ' ' HB2' ' A' ' 830' ' ' SER . 0.9 OUTLIER -56.32 -23.82 39.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.764 0.316 . . . . 2.2000000000000002 110.874 179.788 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.17 -67.94 0.41 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.445 . . . . 2.21 110.674 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . 0.55 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.2 OUTLIER -63.05 -13.29 33.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.345 -0.389 . . . . 0.72999999999999998 110.318 179.492 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.575 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.6 t-105 -80.46 -40.8 25.55 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.716 -0.476 . . . . 0.26000000000000001 109.716 178.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.402 ' HA ' ' HE2' ' A' ' 838' ' ' LYS . 31.4 m-80 -76.49 -26.67 55.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.803 -0.635 . . . . 1.98 110.132 178.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -79.4 -42.76 23.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.831 -0.622 . . . . 0.67000000000000004 109.737 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.19 71.32 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.159 0.504 . . . . 0.22 109.823 178.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 0.6 OUTLIER -66.7 -48.22 69.94 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.631 -0.713 . . . . 0.84999999999999998 110.447 179.416 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -60.15 -27.63 67.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.066 -0.516 . . . . 1.95 110.512 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . 0.405 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 8.0 ttp -72.89 -38.21 67.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.952 -0.567 . . . . 0.29999999999999999 110.487 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.875 HD11 HD23 ' A' ' 849' ' ' LEU . 7.8 mt -72.77 -18.03 61.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.46999999999999997 110.905 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.433 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.92 -29.21 44.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.48999999999999999 111.339 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.11 1.08 1.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 1.6799999999999999 110.752 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.433 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.1 OUTLIER -144.82 13.31 1.49 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 1.96 110.855 -179.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 58.4 18.83 5.89 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.156 -0.475 . . . . 1.99 111.065 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.25 166.66 23.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 2.2999999999999998 110.901 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.16 16.38 0.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 1.98 111.02 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.486 ' HB3' HG22 ' A' ' 782' ' ' THR . 68.6 m-85 -112.48 113.11 25.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 1.0900000000000001 110.723 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.875 HD23 HD11 ' A' ' 841' ' ' LEU . 0.2 OUTLIER -100.9 130.58 46.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.73999999999999999 110.937 -179.75 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.45 ' C ' HG12 ' A' ' 851' ' ' ILE . 3.7 m-20 -96.11 153.98 17.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.187 -0.461 . . . . 1.52 111.324 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 0.542 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.332 -0.16 0 CA-C-N 116.069 -0.514 . . . . 1.04 111.066 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.535 HG21 HD22 ' A' ' 850' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.766 0.317 . . . . 1.22 110.881 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 781' ' ' PHE . . . . . 1.043 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.3 OUTLIER -142.09 83.65 1.85 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.665 -0.494 . . . . 0.93999999999999995 109.665 179.586 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 782' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.9 OUTLIER -98.12 123.44 42.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.743 -0.662 . . . . 0.67000000000000004 111.43 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.78 -165.54 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.693 -0.685 . . . . 1.5700000000000001 110.699 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 784' ' ' LEU . . . . . 0.415 HD12 ' HG3' ' A' ' 847' ' ' LYS . 0.4 OUTLIER -117.1 104.17 10.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.184 -0.462 . . . . 0.81000000000000005 110.271 179.499 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.531 HG21 ' HH2' ' A' ' 834' ' ' TRP . 33.8 m -97.66 -174.75 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.963 -0.562 . . . . 1.1799999999999999 111.59 -179.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 786' ' ' GLU . . . . . 0.423 ' HG2' HG12 ' A' ' 788' ' ' VAL . 1.1 tt0 -139.22 162.37 35.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.925 -0.58 . . . . 1.3999999999999999 110.759 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 787' ' ' LYS . . . . . 0.464 ' HA ' ' HD2' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -70.92 -7.95 49.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 2.8500000000000001 111.001 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 788' ' ' VAL . . . . . 0.423 HG12 ' HG2' ' A' ' 786' ' ' GLU . 3.0 p -100.33 -25.92 3.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.989 -0.551 . . . . 0.33000000000000002 110.955 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -56.29 121.91 10.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.955 -0.566 . . . . 0.29999999999999999 111.739 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 790' ' ' ASN . . . . . 0.457 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.0 OUTLIER -90.98 165.56 13.48 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.865 -0.791 . . . . 1.8899999999999999 108.865 178.226 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 791' ' ' PHE . . . . . 0.44 ' O ' HG12 ' A' ' 795' ' ' ILE . 53.3 t80 -52.04 -27.51 13.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.986 0.422 . . . . 0.63 110.089 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 792' ' ' ASP . . . . . 0.635 ' O ' ' HG3' ' A' ' 796' ' ' MET . 11.5 m-20 -69.43 -59.71 2.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.568 . . . . 2.0499999999999998 109.815 178.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.14 -32.91 62.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.149 -0.478 . . . . 1.0700000000000001 110.261 179.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.485 HD22 ' CE2' ' A' ' 834' ' ' TRP . 34.1 tp -62.41 -54.37 41.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.809 -0.632 . . . . 0.93000000000000005 110.0 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 795' ' ' ILE . . . . . 0.669 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 31.3 mm -58.02 -31.53 41.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.42 -0.809 . . . . 0.32000000000000001 111.696 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 796' ' ' MET . . . . . 0.635 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 20.3 mtt -65.94 -47.8 73.48 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.965 -0.294 . . . . 1.53 110.814 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -56.54 -55.54 32.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.104 0.478 . . . . 0.38 109.903 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 88.6 mt -55.48 -52.49 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.644 -0.707 . . . . 0.5 110.628 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 799' ' ' ASN . . . . . 0.669 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.5 OUTLIER -55.57 -32.14 62.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.609 -0.723 . . . . 0.81000000000000005 111.538 -179.56 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.76 -19.3 57.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.887 0.375 . . . . 0.97999999999999998 110.868 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 801' ' ' LYS . . . . . 0.489 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.1 OUTLIER -106.93 -0.69 22.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.114 -0.494 . . . . 2.25 111.478 -179.907 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 802' ' ' ILE . . . . . 0.597 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.9 pp -119.49 -25.42 2.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.755 0.312 . . . . 0.75 111.511 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 93.0 p . . . . . 0 C--N 1.33 -0.267 0 CA-C-O 120.972 0.415 . . . . 1.53 111.082 -179.815 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo . . . . . 0 C--O 1.231 0.153 0 CA-C-O 120.864 0.277 . . . . 0.94999999999999996 112.285 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 813' ' ' ILE . . . . . 0.421 HG13 HD13 ' A' ' 802' ' ' ILE . 1.2 pp -133.13 -175.78 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 1.9399999999999999 111.201 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.02 -50.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 1.1599999999999999 111.111 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -99.3 117.41 33.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.265 -0.425 . . . . 2.6899999999999999 110.909 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 816' ' ' ILE . . . . . 0.598 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -135.62 178.9 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.109 -0.496 . . . . 0.83999999999999997 111.28 -179.917 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 817' ' ' LYS . . . . . 0.715 ' HE2' HG13 ' A' ' 827' ' ' VAL . 19.5 mttt -117.92 163.71 16.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.955 -0.566 . . . . 0.84999999999999998 110.295 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 818' ' ' TYR . . . . . 0.652 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 20.1 p90 -132.93 158.6 42.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.881 0.372 . . . . 0.70999999999999996 111.145 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 819' ' ' GLN . . . . . 0.727 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 2.3 tp60 -96.2 108.02 20.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.18 0.514 . . . . 1.9099999999999999 110.327 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -79.33 174.82 11.18 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.564 -0.744 . . . . 1.8 110.882 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . 0.411 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.1 OUTLIER -81.8 40.28 0.59 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.101 -0.5 . . . . 1.6200000000000001 111.116 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -140.11 11.76 2.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 1.6499999999999999 110.618 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 61.69 56.23 24.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.83 -0.7 . . . . 0.88 112.338 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -169.99 132.96 1.14 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.956 0.408 . . . . 1.8600000000000001 110.82 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 825' ' ' PHE . . . . . 0.48 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 77.0 m-85 -77.43 129.04 35.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.886 -0.597 . . . . 0.64000000000000001 110.958 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 826' ' ' VAL . . . . . 0.652 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 0.9 OUTLIER -107.65 167.69 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 116.106 -0.497 . . . . 0.96999999999999997 111.057 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 827' ' ' VAL . . . . . 0.715 HG13 ' HE2' ' A' ' 817' ' ' LYS . 0.2 OUTLIER -99.67 104.48 16.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.267 -0.424 . . . . 0.56000000000000005 111.055 179.856 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 2.2 tt -80.21 125.64 30.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.035 -0.53 . . . . 0.81000000000000005 110.782 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -81.31 -56.59 2.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.784 -0.722 . . . . 0.81000000000000005 112.775 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 50.6 p -171.28 -141.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.415 -0.217 . . . . 1.3100000000000001 110.415 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 10.4 p-10 -57.58 -15.43 7.34 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.648 0.261 . . . . 2.2000000000000002 110.908 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -68.48 -76.32 0.09 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.313 -0.403 . . . . 2.21 110.699 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -11.49 17.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.34 -0.391 . . . . 0.72999999999999998 110.365 179.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 834' ' ' TRP . . . . . 0.531 ' HH2' HG21 ' A' ' 785' ' ' VAL . 1.4 t-105 -79.95 -38.53 32.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.138 0.494 . . . . 0.26000000000000001 109.931 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 835' ' ' ASN . . . . . 0.701 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -76.14 -34.28 59.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.768 -0.651 . . . . 1.98 110.005 179.018 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -72.18 -43.93 65.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.484 -0.78 . . . . 0.67000000000000004 109.861 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -69.0 -25.25 64.42 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.207 -0.451 . . . . 0.22 110.115 178.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 838' ' ' LYS . . . . . 0.701 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 30.3 mtmt -72.91 -40.9 65.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.958 -0.565 . . . . 0.84999999999999998 110.066 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 -64.68 -31.48 72.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.97 -0.559 . . . . 1.95 110.039 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 840' ' ' MET . . . . . 0.411 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 10.2 ttp -67.81 -38.96 83.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.829 -0.623 . . . . 0.29999999999999999 110.14 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 841' ' ' LEU . . . . . 0.965 HD11 HD23 ' A' ' 849' ' ' LEU . 47.1 mt -69.61 -37.68 76.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.82 -0.627 . . . . 0.46999999999999997 110.725 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 842' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -67.8 -29.69 68.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.48999999999999999 111.083 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -67.31 1.89 1.95 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.114 -0.493 . . . . 1.6799999999999999 110.614 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 844' ' ' ASN . . . . . 0.406 ' H ' ' C ' ' A' ' 842' ' ' ALA . 13.6 m120 -142.76 17.18 1.98 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 1.96 110.928 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 59.51 15.87 4.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.177 -0.465 . . . . 1.99 111.041 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -79.75 166.25 21.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 2.2999999999999998 110.85 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 847' ' ' LYS . . . . . 0.415 ' HG3' HD12 ' A' ' 784' ' ' LEU . 0.0 OUTLIER -157.01 12.46 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 1.98 110.949 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 848' ' ' PHE . . . . . 0.411 ' HB3' ' CG2' ' A' ' 782' ' ' THR . 5.2 m-85 -108.3 127.63 54.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 1.0900000000000001 110.973 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 849' ' ' LEU . . . . . 0.965 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -118.28 128.98 55.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.151 -0.477 . . . . 0.73999999999999999 110.973 -179.798 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 850' ' ' ASN . . . . . 0.727 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 6.7 m120 -89.22 167.32 13.19 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.948 -0.569 . . . . 1.52 111.313 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 851' ' ' ILE . . . . . 1.043 HD12 ' HB3' ' A' ' 781' ' ' PHE . 53.3 mt . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.404 -0.362 . . . . 1.04 111.314 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.126 0 N-CA-C 112.447 -0.261 . . . . 9.0999999999999996 112.447 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -92.11 -0.24 57.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.763 0.316 . . . . 8.1199999999999992 111.218 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 73.9 mmm -90.31 -42.25 11.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 8.3399999999999999 111.035 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 90.11 111.18 1.42 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.761 -0.733 . . . . 4.25 112.493 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . 0.432 ' HB2' HD12 ' A' ' 853' ' ' LEU . 0.6 OUTLIER -128.96 163.02 26.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.827 0.346 . . . . 2.6099999999999999 111.055 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.507 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 1.1 mt -120.84 165.02 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 1.22 110.927 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.759 ' HB2' ' HB ' ' A' ' 851' ' ' ILE . 0.7 OUTLIER -143.39 84.72 1.82 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.268 -0.423 . . . . 0.93999999999999995 110.366 179.735 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.624 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.2 OUTLIER -98.0 103.28 15.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.905 -0.589 . . . . 0.67000000000000004 110.6 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.717 HD22 ' HE2' ' A' ' 801' ' ' LYS . 0.1 OUTLIER -112.56 -166.44 1.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.626 -0.715 . . . . 1.5700000000000001 110.732 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.79 112.06 19.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.056 -0.52 . . . . 0.81000000000000005 110.035 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 10.1 m -103.67 157.1 5.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.998 -0.546 . . . . 1.1799999999999999 111.138 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.548 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 4.1 tp10 -102.8 170.45 7.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 1.3999999999999999 110.978 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . 0.548 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.4 OUTLIER -83.65 27.04 0.64 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 2.8500000000000001 110.6 179.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -136.58 -25.44 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.932 -0.576 . . . . 0.33000000000000002 110.57 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -52.6 123.15 10.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.702 -0.681 . . . . 0.29999999999999999 111.939 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.98 166.03 12.9 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.733 -0.84 . . . . 1.8899999999999999 108.733 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.495 ' O ' HG12 ' A' ' 795' ' ' ILE . 93.0 t80 -52.71 -28.46 22.05 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.693 -0.403 . . . . 0.63 110.165 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.515 ' O ' ' HG3' ' A' ' 796' ' ' MET . 14.6 t70 -68.75 -56.24 8.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.07 -0.514 . . . . 2.0499999999999998 109.702 178.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . 0.459 ' HA ' ' HG3' ' A' ' 796' ' ' MET . 1.2 t0 -57.44 -33.05 67.52 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.969 -0.56 . . . . 1.0700000000000001 110.232 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.51 HD22 ' CE2' ' A' ' 834' ' ' TRP . 30.5 tp -63.69 -53.16 55.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.864 -0.607 . . . . 0.93000000000000005 109.91 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.66 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 35.8 mm -56.62 -27.01 24.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.645 -0.707 . . . . 0.32000000000000001 111.23 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.515 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 10.5 mtp -67.66 -46.95 70.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.724 0.297 . . . . 1.53 110.458 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . 0.439 ' O ' ' HD3' ' A' ' 801' ' ' LYS . . . -56.87 -53.68 55.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.037 0.446 . . . . 0.38 109.935 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.529 HD11 HD12 ' A' ' 851' ' ' ILE . 75.4 mt -57.95 -51.44 70.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.746 -0.661 . . . . 0.5 110.616 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.66 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t-20 -56.27 -26.96 53.65 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.519 -0.764 . . . . 0.81000000000000005 111.325 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . 0.506 ' HA ' ' HB2' ' A' ' 804' ' ' ASN . 0.1 OUTLIER -80.11 -23.47 41.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.317 -0.401 . . . . 0.97999999999999998 110.614 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . 0.717 ' HE2' HD22 ' A' ' 783' ' ' LEU . 0.5 OUTLIER -101.08 -1.67 33.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.952 -0.567 . . . . 2.25 111.179 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.673 HD13 HG12 ' A' ' 813' ' ' ILE . 1.4 pp -117.14 -29.42 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.453 -0.34 . . . . 0.75 111.349 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . 0.515 ' HB2' HD12 ' A' ' 802' ' ' ILE . 0.5 OUTLIER -166.03 85.05 0.32 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.283 -0.417 . . . . 1.53 110.871 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . 0.506 ' HB2' ' HA ' ' A' ' 800' ' ' SER . 8.6 t-20 -122.01 -17.07 7.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.475 . . . . 2.8300000000000001 110.925 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.05 134.36 33.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 4.2000000000000002 111.212 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -101.82 103.15 13.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 7.6900000000000004 110.888 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -118.09 -70.53 0.79 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.051 -0.522 . . . . 6.2199999999999998 110.765 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -132.63 -73.47 0.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.058 -0.519 . . . . 6.8300000000000001 110.678 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -130.91 136.87 48.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.907 -0.588 . . . . 6.4100000000000001 110.628 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 1.6 pt -121.54 160.57 22.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 4.7800000000000002 111.418 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.21 95.14 10.64 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 1.8 110.689 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.83 -176.29 2.27 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.556 2.171 . . . . 0.94999999999999996 112.486 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.673 HG12 HD13 ' A' ' 802' ' ' ILE . 4.4 pt -145.05 171.87 5.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.122 -0.49 . . . . 1.9399999999999999 110.931 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 3.2 p -144.57 -53.81 0.32 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.319 -0.401 . . . . 1.1599999999999999 111.271 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -81.98 114.92 20.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 2.6899999999999999 110.767 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . 0.595 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -136.08 169.27 20.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.232 -0.44 . . . . 0.83999999999999997 111.318 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 8.9 mttt -110.58 166.68 10.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.025 -0.534 . . . . 0.84999999999999998 110.421 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.571 ' CE1' HG23 ' A' ' 826' ' ' VAL . 10.6 p90 -149.77 152.94 36.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.973 0.416 . . . . 0.70999999999999996 111.377 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . 0.41 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -76.74 108.01 9.45 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.933 -0.576 . . . . 1.9099999999999999 110.672 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.544 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.0 t70 -78.97 179.3 7.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.383 -0.826 . . . . 1.8 110.792 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.71 35.96 0.53 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 1.6200000000000001 111.051 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.33 16.27 3.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.32 -0.4 . . . . 1.6499999999999999 110.999 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 60.98 46.45 94.55 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.787 -0.721 . . . . 0.88 112.319 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -174.02 134.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.972 0.415 . . . . 1.8600000000000001 110.65 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.421 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 72.5 m-85 -65.7 144.97 56.58 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.944 -0.571 . . . . 0.64000000000000001 110.766 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.571 HG23 ' CE1' ' A' ' 818' ' ' TYR . 1.0 OUTLIER -130.03 179.56 4.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.96999999999999997 110.903 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.7 113.57 33.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.981 0.42 . . . . 0.56000000000000005 111.397 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.97 131.5 34.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.804 -0.634 . . . . 0.81000000000000005 110.725 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -76.76 -68.52 1.51 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.723 -0.751 . . . . 0.81000000000000005 112.669 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 90.7 p -170.17 -137.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.38 -0.23 . . . . 1.3100000000000001 110.38 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -54.45 -27.93 40.81 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.907 0.384 . . . . 2.2000000000000002 110.65 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.544 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.9 OUTLIER -63.92 -68.41 0.35 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.08 -0.509 . . . . 2.21 110.882 179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -11.28 28.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.3 -0.409 . . . . 0.72999999999999998 110.674 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.516 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.5 t-105 -82.86 -41.65 18.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.26000000000000001 110.176 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 54.9 m-20 -73.42 -27.33 61.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.048 -0.524 . . . . 1.98 110.001 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 832' ' ' GLU . 51.0 t -78.84 -51.42 17.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.771 -0.65 . . . . 0.67000000000000004 109.928 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.45 66.34 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.991 -0.55 . . . . 0.22 110.314 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.428 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 1.7 mtpp -67.16 -49.34 65.09 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.877 -0.602 . . . . 0.84999999999999998 110.467 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.88 -24.77 66.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 1.95 110.334 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.9 ttp -75.56 -34.05 60.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.84 -0.618 . . . . 0.29999999999999999 110.37 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.805 HD11 HD23 ' A' ' 849' ' ' LEU . 27.8 mt -69.98 -47.42 62.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.915 -0.584 . . . . 0.46999999999999997 110.803 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.53 -3.64 44.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.48999999999999999 111.404 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -3.49 2.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.971 0.415 . . . . 1.6799999999999999 110.171 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.416 ' H ' ' C ' ' A' ' 842' ' ' ALA . 1.5 m120 -145.35 -73.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.771 -0.649 . . . . 1.96 110.322 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -179.26 27.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.833 -0.622 . . . . 1.99 110.921 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.22 142.96 30.98 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.291 -0.413 . . . . 2.2999999999999998 110.913 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -132.91 -16.65 2.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.947 -0.569 . . . . 1.98 110.698 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.624 ' HB3' HG22 ' A' ' 782' ' ' THR . 32.7 m-85 -84.46 144.9 28.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.171 -0.468 . . . . 1.0900000000000001 111.133 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.805 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -124.42 131.19 53.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.935 -0.575 . . . . 0.73999999999999999 110.516 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.446 ' C ' HG12 ' A' ' 851' ' ' ILE . 10.5 m120 -89.87 153.58 20.53 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.885 -0.598 . . . . 1.52 111.185 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.759 ' HB ' ' HB2' ' A' ' 781' ' ' PHE . 1.5 mm -137.12 159.0 36.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 116.123 -0.49 . . . . 1.04 111.413 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.425 ' N ' HG22 ' A' ' 851' ' ' ILE . 0.3 OUTLIER -128.16 163.88 23.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.818 0.342 . . . . 5.0899999999999999 110.782 179.669 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . 0.432 HD12 ' HB2' ' A' ' 779' ' ' SER . 32.5 mt -128.69 78.01 1.82 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 2.6000000000000001 110.852 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.233 -0.889 . . . . 3.3900000000000001 110.903 179.949 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.51 -0.236 . . . . 9.0999999999999996 112.51 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -89.83 175.95 7.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.773 0.32 . . . . 8.1199999999999992 111.14 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.53 148.65 40.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 8.3399999999999999 110.818 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -133.1 -152.48 6.91 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.648 -0.787 . . . . 4.25 112.492 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . 0.471 ' O ' ' HB3' ' A' ' 853' ' ' LEU . 0.0 OUTLIER -148.51 -169.99 3.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.723 0.297 . . . . 2.6099999999999999 111.047 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.53 -172.6 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 1.22 110.949 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 1.001 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.3 OUTLIER -153.77 92.05 1.52 Allowed 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.053 0.454 . . . . 0.93999999999999995 110.006 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.561 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -97.43 97.93 9.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.736 -0.666 . . . . 0.67000000000000004 110.89 -179.349 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.5 OUTLIER -91.56 146.73 23.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.595 -0.73 . . . . 1.5700000000000001 111.086 -179.671 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.78 108.98 12.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.404 . . . . 0.81000000000000005 110.555 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 847' ' ' LYS . 17.3 m -98.48 -166.6 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.898 -0.592 . . . . 1.1799999999999999 111.371 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.582 ' HG2' HG12 ' A' ' 788' ' ' VAL . 0.8 OUTLIER -140.37 171.55 13.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.278 -0.419 . . . . 1.3999999999999999 111.003 -179.856 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.03 20.15 2.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 2.8500000000000001 110.853 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . 0.582 HG12 ' HG2' ' A' ' 786' ' ' GLU . 1.7 p -136.18 -26.33 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.777 -0.647 . . . . 0.33000000000000002 110.72 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 24.5 m0 -51.92 126.63 18.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.935 -0.575 . . . . 0.29999999999999999 111.848 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . 0.484 HD22 ' H ' ' A' ' 793' ' ' ASP . 0.0 OUTLIER -93.11 168.67 10.96 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.051 -0.722 . . . . 1.8899999999999999 109.051 178.313 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.407 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 69.8 t80 -54.4 -24.75 21.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.011 0.434 . . . . 0.63 110.06 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.654 ' O ' ' HG3' ' A' ' 796' ' ' MET . 26.3 t0 -73.19 -61.78 1.7 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.803 -0.635 . . . . 2.0499999999999998 109.851 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . 0.484 ' H ' HD22 ' A' ' 790' ' ' ASN . 3.0 m-20 -54.01 -27.35 31.31 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.159 -0.473 . . . . 1.0700000000000001 110.045 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.576 HD22 ' CE2' ' A' ' 834' ' ' TRP . 32.1 tp -68.55 -58.12 4.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.783 -0.644 . . . . 0.93000000000000005 110.403 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.7 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 19.9 mm -56.86 -32.24 38.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.521 -0.763 . . . . 0.32000000000000001 111.647 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.654 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.5 mtt -66.81 -52.87 38.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.7 0.286 . . . . 1.53 110.601 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.89 -54.94 31.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.022 0.439 . . . . 0.38 110.192 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 46.6 mt -56.26 -48.77 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.763 -0.653 . . . . 0.5 110.52 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.7 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.2 t-20 -57.96 -23.84 55.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.871 -0.604 . . . . 0.81000000000000005 111.099 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.81 -24.21 38.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.031 0.444 . . . . 0.97999999999999998 110.316 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . 0.519 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -101.85 -2.34 30.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.766 -0.652 . . . . 2.25 111.297 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.57 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.8 pp -121.2 -25.11 2.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.79 0.328 . . . . 0.75 111.414 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 44.1 t -133.6 11.43 4.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.285 -0.416 . . . . 1.53 110.825 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 56.74 -163.61 0.17 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.064 -0.516 . . . . 2.8300000000000001 111.035 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 1.9 p -83.79 -27.59 28.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 4.2000000000000002 110.985 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -113.18 139.39 48.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 7.6900000000000004 110.828 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -98.18 110.39 22.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 6.2199999999999998 111.072 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -110.47 63.55 0.61 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.507 . . . . 6.8300000000000001 110.717 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 57.35 55.5 5.77 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.048 -0.524 . . . . 6.4100000000000001 110.854 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -116.68 -11.6 11.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.096 -0.502 . . . . 4.7800000000000002 111.042 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 59.79 94.87 0.05 OUTLIER Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.992 -0.549 . . . . 1.8 111.134 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.18 -169.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.819 2.346 . . . . 0.94999999999999996 112.269 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 42.2 pt -136.22 154.68 33.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.9 0.381 . . . . 1.9399999999999999 111.436 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 9.8 p -133.44 -64.23 0.73 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.969 -0.559 . . . . 1.1599999999999999 110.824 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.44 123.38 32.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.486 . . . . 2.6899999999999999 110.31 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . 0.825 HG22 ' HD3' ' A' ' 852' ' ' ARG . 1.7 pp -144.65 174.14 3.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.066 0.46 . . . . 0.83999999999999997 111.89 -179.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.78 ' H ' ' HG2' ' A' ' 852' ' ' ARG . 5.4 mmtp -105.54 172.94 6.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.649 -0.705 . . . . 0.84999999999999998 110.32 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.576 ' CE1' HG23 ' A' ' 826' ' ' VAL . 9.0 p90 -158.03 163.01 38.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.932 0.396 . . . . 0.70999999999999996 111.421 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . 0.491 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 0.4 OUTLIER -82.32 107.59 15.11 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.902 -0.59 . . . . 1.9099999999999999 110.713 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.446 ' HB3' HG22 ' A' ' 826' ' ' VAL . 0.2 OUTLIER -79.02 -178.76 6.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.479 -0.782 . . . . 1.8 110.795 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -82.86 38.61 0.59 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.294 -0.412 . . . . 1.6200000000000001 111.284 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -140.16 9.1 2.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.34 -0.391 . . . . 1.6499999999999999 110.848 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . 0.41 ' HA2' ' NE2' ' A' ' 819' ' ' GLN . . . 65.1 49.08 63.96 Favored Glycine 0 C--N 1.331 0.258 0 C-N-CA 120.682 -0.771 . . . . 0.88 112.287 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -169.29 134.3 1.5 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.982 0.42 . . . . 1.8600000000000001 110.617 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.511 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 94.5 m-85 -63.69 136.03 57.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.881 -0.599 . . . . 0.64000000000000001 110.871 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.576 HG23 ' CE1' ' A' ' 818' ' ' TYR . 3.0 m -126.46 179.15 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 0.96999999999999997 110.595 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.93 114.53 36.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.954 0.407 . . . . 0.56000000000000005 111.537 -179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 4.8 tp -83.17 122.44 28.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.809 -0.632 . . . . 0.81000000000000005 110.86 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.29 -75.36 0.48 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.783 -0.722 . . . . 0.81000000000000005 112.619 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -161.75 -141.97 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 110.499 -0.186 . . . . 1.3100000000000001 110.499 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -59.41 -16.39 22.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.729 0.3 . . . . 2.2000000000000002 110.84 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.553 ' O ' HG23 ' A' ' 836' ' ' VAL . 29.1 mt-10 -75.05 -66.32 0.77 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.235 -0.439 . . . . 2.21 110.613 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -61.59 -15.15 36.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.285 -0.416 . . . . 0.72999999999999998 110.263 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.576 ' CE2' HD22 ' A' ' 794' ' ' LEU . 2.8 t-105 -82.37 -39.27 22.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.26000000000000001 109.59 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.721 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -69.61 -37.74 76.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.86 -0.609 . . . . 1.98 109.751 178.776 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 832' ' ' GLU . 24.3 t -69.88 -54.65 18.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.557 -0.747 . . . . 0.67000000000000004 109.675 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.97 -24.72 40.14 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.855 -0.612 . . . . 0.22 110.324 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.721 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 27.8 mtmt -71.88 -45.49 61.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.835 -0.62 . . . . 0.84999999999999998 110.317 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -65.22 -17.64 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.835 -0.621 . . . . 1.95 110.349 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 6.2 ttp -83.46 -33.85 25.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.683 -0.69 . . . . 0.29999999999999999 110.403 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.911 HD11 HD23 ' A' ' 849' ' ' LEU . 20.5 mt -68.84 -45.79 70.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.46999999999999997 110.898 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -64.88 -28.14 69.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.48999999999999999 111.407 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.81 8.26 0.93 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.227 -0.442 . . . . 1.6799999999999999 110.74 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.434 ' H ' ' C ' ' A' ' 842' ' ' ALA . 11.2 m-80 -146.53 16.56 1.29 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.018 -0.537 . . . . 1.96 110.802 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 59.93 19.6 8.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.051 -0.522 . . . . 1.99 111.128 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . 0.438 ' HB3' HD22 ' A' ' 841' ' ' LEU . 3.2 mt-10 -83.5 170.85 13.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.422 -0.354 . . . . 2.2999999999999998 110.654 179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . 0.487 ' O ' HG22 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -152.07 -30.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.425 -0.352 . . . . 1.98 111.273 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.462 ' HB3' ' HB ' ' A' ' 782' ' ' THR . 4.1 m-85 -82.4 143.09 31.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.918 0.39 . . . . 1.0900000000000001 111.041 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.911 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -122.29 121.33 36.5 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.04 -0.527 . . . . 0.73999999999999999 110.744 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.491 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 4.6 m-20 -75.45 161.65 29.03 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.993 -0.549 . . . . 1.52 111.327 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 1.001 HD12 ' HB3' ' A' ' 781' ' ' PHE . 6.0 mt -133.44 165.01 33.43 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.104 0 CA-C-N 116.184 -0.462 . . . . 1.04 111.025 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.825 ' HD3' HG22 ' A' ' 816' ' ' ILE . 1.4 ptm180 -44.84 -86.52 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.458 -0.337 . . . . 5.0899999999999999 111.684 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . 0.471 ' HB3' ' O ' ' A' ' 779' ' ' SER . 0.4 OUTLIER 53.85 26.46 6.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.415 -0.357 . . . . 2.6000000000000001 111.034 -179.69 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 24.2 p90 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.129 -0.939 . . . . 3.3900000000000001 110.86 179.952 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.532 -0.227 . . . . 9.0999999999999996 112.532 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -122.53 -22.3 5.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.776 0.322 . . . . 8.1199999999999992 111.054 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 5.4 mtt -95.95 -39.76 9.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 8.3399999999999999 110.991 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 89.57 116.22 1.58 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.833 -0.699 . . . . 4.25 112.291 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 43.6 p -92.53 132.83 36.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.871 0.367 . . . . 2.6099999999999999 111.139 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.496 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -109.43 -178.64 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.155 -0.475 . . . . 1.22 110.855 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.659 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.37 97.45 1.23 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.985 0.422 . . . . 0.93999999999999995 109.911 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.526 HG23 ' OD1' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -96.86 94.14 7.07 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.297 0.57 . . . . 0.67000000000000004 110.765 -179.438 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.445 ' HA ' HD22 ' A' ' 783' ' ' LEU . 0.2 OUTLIER -92.16 114.65 27.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.42 -0.809 . . . . 1.5700000000000001 111.036 -179.489 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.486 HD12 ' HE1' ' A' ' 848' ' ' PHE . 6.8 tt -62.12 103.99 0.43 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.072 -0.513 . . . . 0.81000000000000005 110.535 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.445 HG21 ' HH2' ' A' ' 834' ' ' TRP . 26.3 m -98.4 -172.0 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.979 -0.555 . . . . 1.1799999999999999 111.413 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.43 176.27 8.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.138 -0.483 . . . . 1.3999999999999999 110.882 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.98 35.46 0.79 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.097 0.475 . . . . 2.8500000000000001 110.806 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.0 p -150.77 -28.38 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.674 -0.694 . . . . 0.33000000000000002 110.896 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 23.3 m0 -49.06 124.24 8.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.826 -0.624 . . . . 0.29999999999999999 111.736 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.66 166.66 12.68 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.142 -0.688 . . . . 1.8899999999999999 109.142 178.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.433 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 77.2 t80 -52.83 -24.1 8.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.944 0.402 . . . . 0.63 110.172 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.656 ' O ' ' HG3' ' A' ' 796' ' ' MET . 2.1 t70 -72.25 -62.49 1.42 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.868 -0.605 . . . . 2.0499999999999998 109.697 178.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -53.63 -27.02 24.71 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 116.158 -0.474 . . . . 1.0700000000000001 110.356 179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.627 HD22 ' CE2' ' A' ' 834' ' ' TRP . 26.9 tp -70.19 -54.34 13.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.858 -0.61 . . . . 0.93000000000000005 110.478 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.687 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 23.5 mm -59.23 -34.1 52.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.654 -0.703 . . . . 0.32000000000000001 111.868 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.656 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 21.8 mtm -71.17 -43.4 67.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.636 0.255 . . . . 1.53 111.067 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.95 79.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.272 0.558 . . . . 0.38 109.975 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.474 ' O ' HG23 ' A' ' 802' ' ' ILE . 48.1 mt -62.94 -47.8 91.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.446 -0.797 . . . . 0.5 110.281 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.742 ' HA ' HG12 ' A' ' 802' ' ' ILE . 0.8 OUTLIER -56.13 -29.58 60.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.846 -0.616 . . . . 0.81000000000000005 111.133 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.84 -29.49 58.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.97999999999999998 110.848 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . 0.539 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -94.41 -3.93 49.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 2.25 111.467 -179.77 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.742 HG12 ' HA ' ' A' ' 799' ' ' ASN . 7.0 pt -113.76 -22.15 5.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.761 0.315 . . . . 0.75 111.244 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.29 92.03 0.54 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.258 -0.428 . . . . 1.53 111.006 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -103.14 -13.25 16.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 2.8300000000000001 110.8 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -114.61 159.81 20.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 4.2000000000000002 110.968 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -110.29 164.27 12.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.439 . . . . 7.6900000000000004 110.86 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 55.26 69.9 0.69 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.088 -0.505 . . . . 6.2199999999999998 110.888 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -119.42 -66.72 1.04 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.115 -0.493 . . . . 6.8300000000000001 110.836 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -167.25 -41.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.455 . . . . 6.4100000000000001 110.921 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 4.6 pt -130.65 177.79 6.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.167 -0.469 . . . . 4.7800000000000002 111.164 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.45 154.77 37.01 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.047 -0.524 . . . . 1.8 110.88 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -51.1 156.31 5.25 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.612 2.208 . . . . 0.94999999999999996 112.484 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 4.4 mm -107.61 148.7 11.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 1.9399999999999999 111.092 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 82.1 p -115.94 -47.2 2.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.25 -0.432 . . . . 1.1599999999999999 111.374 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.94 139.18 30.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.266 -0.425 . . . . 2.6899999999999999 111.093 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -150.63 168.77 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.126 -0.488 . . . . 0.83999999999999997 111.169 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.638 ' HE2' HG13 ' A' ' 827' ' ' VAL . 14.6 mmtt -115.45 134.63 54.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 0.84999999999999998 110.646 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.602 ' CE1' HG23 ' A' ' 826' ' ' VAL . 5.4 p90 -113.33 168.48 9.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.893 0.378 . . . . 0.70999999999999996 111.26 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -93.68 105.99 17.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.975 -0.557 . . . . 1.9099999999999999 110.761 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.456 ' HB2' HG22 ' A' ' 826' ' ' VAL . 4.6 t0 -79.07 169.65 17.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.83 -0.623 . . . . 1.8 110.373 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.9 52.65 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.189 0.518 . . . . 1.6200000000000001 111.105 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 -141.05 1.5 1.65 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.679 -0.691 . . . . 1.6499999999999999 110.463 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 74.6 44.44 26.39 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.882 -0.675 . . . . 0.88 111.982 -179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -174.08 142.44 0.84 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 121.164 0.507 . . . . 1.8600000000000001 110.57 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.438 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 70.6 m-85 -72.25 147.26 46.64 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.625 -0.716 . . . . 0.64000000000000001 110.462 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.602 HG23 ' CE1' ' A' ' 818' ' ' TYR . 2.4 m -137.48 177.92 5.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.305 -0.407 . . . . 0.96999999999999997 110.726 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . 0.638 HG13 ' HE2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -98.93 118.65 45.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.019 0.438 . . . . 0.56000000000000005 111.35 -179.626 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.457 HD12 ' HB3' ' A' ' 833' ' ' ASP . 3.5 tp -79.75 113.67 18.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.767 -0.651 . . . . 0.81000000000000005 110.745 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -58.01 -71.75 0.7 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.995 -0.621 . . . . 0.81000000000000005 112.751 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 57.4 p -171.07 -136.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.502 0.191 . . . . 1.3100000000000001 110.732 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.459 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 0.7 OUTLIER -57.85 -20.59 37.44 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.771 0.32 . . . . 2.2000000000000002 110.967 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.487 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.5 OUTLIER -72.62 -68.29 0.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.428 . . . . 2.21 110.947 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . 0.457 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.6 OUTLIER -60.9 -13.35 15.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.72999999999999998 110.793 179.776 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.627 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.5 t-105 -86.26 -40.38 15.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.9 0.381 . . . . 0.26000000000000001 110.111 179.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.743 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -68.91 -37.09 78.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.95 -0.568 . . . . 1.98 109.885 179.064 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 832' ' ' GLU . 39.9 t -72.25 -54.47 16.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.462 -0.79 . . . . 0.67000000000000004 110.149 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.01 -25.48 61.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.0 -0.545 . . . . 0.22 110.601 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.743 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 23.8 mtmt -69.73 -42.67 73.66 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.169 -0.469 . . . . 0.84999999999999998 110.191 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 5.0 mt-10 -68.11 -25.93 65.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.061 -0.518 . . . . 1.95 110.161 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 12.4 ttp -74.97 -35.72 62.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.746 -0.661 . . . . 0.29999999999999999 110.497 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.646 HD11 HD23 ' A' ' 849' ' ' LEU . 15.4 mt -67.69 -49.21 63.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.46999999999999997 110.917 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . . . . . . . . . . . -80.46 -0.34 36.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.48999999999999999 111.544 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 0.5 OUTLIER -66.43 -0.86 2.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.998 0.428 . . . . 1.6799999999999999 110.377 179.466 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -149.74 -71.2 0.19 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.847 -0.615 . . . . 1.96 110.63 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -177.82 26.33 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.959 -0.564 . . . . 1.99 111.162 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -100.62 140.93 34.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.824 0.345 . . . . 2.2999999999999998 110.876 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.3 2.84 2.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 1.98 110.931 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.486 ' HE1' HD12 ' A' ' 784' ' ' LEU . 0.5 OUTLIER -111.02 126.03 54.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.358 -0.383 . . . . 1.0900000000000001 110.947 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.646 HD23 HD11 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -97.37 133.32 42.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.083 -0.508 . . . . 0.73999999999999999 110.697 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.526 ' OD1' HG23 ' A' ' 782' ' ' THR . 6.5 m-20 -85.59 153.93 22.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 1.52 111.197 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.659 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.4 mm -136.65 162.18 35.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.202 -0.454 . . . . 1.04 111.096 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.58 ' HB3' ' HD1' ' A' ' 854' ' ' TYR . 0.0 OUTLIER -111.46 -44.58 3.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.49 -0.323 . . . . 5.0899999999999999 110.759 179.732 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 2.1 mt 57.99 24.55 11.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.025 -0.534 . . . . 2.6000000000000001 111.074 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . 0.58 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 2.0 p90 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.224 -0.894 . . . . 3.3900000000000001 110.983 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 N-CA-C 112.526 -0.229 . . . . 9.0999999999999996 112.526 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -89.39 86.82 6.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.76 0.314 . . . . 8.1199999999999992 111.275 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 55.3 70.63 0.61 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.082 -0.508 . . . . 8.3399999999999999 111.209 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -87.29 158.57 30.21 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.853 -0.689 . . . . 4.25 112.304 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.66 -173.66 4.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 2.6099999999999999 111.013 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.45 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -127.1 -160.09 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.022 -0.535 . . . . 1.22 110.719 179.927 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.706 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -133.59 78.44 1.77 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.112 0.482 . . . . 0.93999999999999995 110.113 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.1 OUTLIER -98.46 115.7 29.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.67000000000000004 111.378 -179.401 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.51 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -116.9 -167.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.709 -0.678 . . . . 1.5700000000000001 110.672 179.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -116.34 110.92 19.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.028 -0.533 . . . . 0.81000000000000005 110.372 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.639 HG21 ' HH2' ' A' ' 834' ' ' TRP . 28.8 m -107.45 158.57 7.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 1.1799999999999999 111.539 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.618 ' HG2' HG12 ' A' ' 788' ' ' VAL . 1.1 tt0 -110.18 171.06 7.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.983 -0.553 . . . . 1.3999999999999999 110.725 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -79.19 -9.36 59.54 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.039 0.447 . . . . 2.8500000000000001 110.783 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . 0.618 HG12 ' HG2' ' A' ' 786' ' ' GLU . 2.7 p -96.06 -24.26 4.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.785 -0.643 . . . . 0.33000000000000002 110.848 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -56.73 126.17 25.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.29999999999999999 111.931 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.85 167.94 10.79 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.009 -0.737 . . . . 1.8899999999999999 109.009 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.442 ' O ' HG12 ' A' ' 795' ' ' ILE . 80.6 t80 -54.67 -24.3 21.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.885 0.374 . . . . 0.63 110.069 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 796' ' ' MET . 24.1 m-20 -73.58 -57.6 3.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.979 -0.555 . . . . 2.0499999999999998 109.758 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.31 -30.5 64.8 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.166 -0.47 . . . . 1.0700000000000001 110.124 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.531 HD13 ' CZ2' ' A' ' 834' ' ' TRP . 30.2 tp -65.46 -54.72 24.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.712 -0.676 . . . . 0.93000000000000005 110.281 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.656 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 30.3 mm -57.25 -27.98 29.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.484 -0.78 . . . . 0.32000000000000001 111.535 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.5 mtt -68.18 -51.01 50.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.716 0.294 . . . . 1.53 110.548 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.04 -53.06 58.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.057 0.456 . . . . 0.38 109.911 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.469 HG21 HD11 ' A' ' 813' ' ' ILE . 74.2 mt -57.49 -53.02 49.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.643 -0.708 . . . . 0.5 110.428 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.656 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.7 OUTLIER -54.96 -24.64 24.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.563 -0.744 . . . . 0.81000000000000005 111.283 -179.852 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . 0.534 ' HA ' ' HB2' ' A' ' 804' ' ' ASN . 42.1 t -78.79 -27.56 44.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.349 -0.387 . . . . 0.97999999999999998 110.537 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.41 4.6 36.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.985 -0.552 . . . . 2.25 111.358 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.568 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.0 OUTLIER -127.22 -23.63 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 111.933 0.346 . . . . 0.75 111.933 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 34.9 t -122.86 -28.73 4.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.729 0.299 . . . . 1.53 111.078 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . 0.534 ' HB2' ' HA ' ' A' ' 800' ' ' SER . 0.9 OUTLIER -94.5 137.59 33.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.306 -0.406 . . . . 2.8300000000000001 110.952 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 55.94 71.98 0.52 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.121 -0.491 . . . . 4.2000000000000002 111.277 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -130.69 -80.9 0.54 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.395 -0.366 . . . . 7.6900000000000004 110.901 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -146.4 -71.03 0.24 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.165 -0.471 . . . . 6.2199999999999998 110.858 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . 0.4 ' H ' ' H ' ' A' ' 809' ' ' ASN . 40.2 p-10 -173.34 0.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.213 -0.449 . . . . 6.8300000000000001 111.05 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . 0.4 ' H ' ' H ' ' A' ' 808' ' ' ASN . 0.3 OUTLIER -101.32 165.94 11.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.286 -0.415 . . . . 6.4100000000000001 111.022 -179.892 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 2.0 pt -133.55 122.5 43.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.099 -0.501 . . . . 4.7800000000000002 111.013 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 66.8 m -149.6 67.62 8.81 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.241 -0.436 . . . . 1.8 111.168 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.87 168.49 7.08 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.576 2.184 . . . . 0.94999999999999996 112.105 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.544 HG12 HD13 ' A' ' 802' ' ' ILE . 8.7 pt -140.93 -176.25 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.959 0.409 . . . . 1.9399999999999999 111.294 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 1.6 t -158.57 -40.42 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.97 -0.559 . . . . 1.1599999999999999 110.981 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.79 126.92 52.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.081 -0.509 . . . . 2.6899999999999999 110.821 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -155.27 -176.17 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 0.83999999999999997 111.365 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.82 ' H ' ' HB2' ' A' ' 852' ' ' ARG . 17.5 mmtt -108.64 169.67 8.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.84999999999999998 110.595 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.506 ' CE1' HG23 ' A' ' 826' ' ' VAL . 11.0 p90 -157.29 157.25 33.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.988 0.423 . . . . 0.70999999999999996 111.191 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . 0.513 ' HA ' ' O ' ' A' ' 824' ' ' ASP . 55.3 tt0 -76.33 102.15 5.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.897 -0.592 . . . . 1.9099999999999999 111.039 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.5 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.2 t0 -79.24 -176.01 4.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.587 -0.733 . . . . 1.8 110.627 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -81.79 15.13 2.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.362 -0.381 . . . . 1.6200000000000001 111.185 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.34 6.11 44.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.432 . . . . 1.6499999999999999 111.07 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 75.2 16.35 80.65 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.736 . . . . 0.88 112.482 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . 0.513 ' O ' ' HA ' ' A' ' 819' ' ' GLN . 2.8 t0 -143.49 -147.35 0.21 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.754 0.311 . . . . 1.8600000000000001 110.358 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.462 ' HB2' ' OH ' ' A' ' 854' ' ' TYR . 49.3 m-85 -129.02 150.89 50.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.295 -0.411 . . . . 0.64000000000000001 110.895 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.506 HG23 ' CE1' ' A' ' 818' ' ' TYR . 8.4 m -139.14 -178.58 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.96999999999999997 110.558 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -98.64 113.41 33.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.969 0.414 . . . . 0.56000000000000005 111.682 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -80.36 120.27 24.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.909 -0.587 . . . . 0.81000000000000005 110.63 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -68.48 -72.5 0.81 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.847 -0.692 . . . . 0.81000000000000005 112.621 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.79 -136.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.492 0.187 . . . . 1.3100000000000001 110.51 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -59.61 -16.26 24.52 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.702 0.287 . . . . 2.2000000000000002 110.822 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.532 ' O ' HG23 ' A' ' 836' ' ' VAL . 32.0 mt-10 -74.89 -70.4 0.41 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.284 -0.417 . . . . 2.21 110.827 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -61.77 -11.76 13.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.72999999999999998 110.841 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.639 ' HH2' HG21 ' A' ' 785' ' ' VAL . 2.0 t-105 -84.01 -40.7 18.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.891 0.377 . . . . 0.26000000000000001 110.17 179.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.719 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -69.07 -35.22 76.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 1.98 110.024 179.112 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 832' ' ' GLU . 13.2 t -74.71 -53.56 16.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.67000000000000004 110.132 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -56.57 -27.16 57.22 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.124 -0.489 . . . . 0.22 110.488 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.719 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 21.4 mtmt -68.55 -47.89 65.71 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.988 -0.551 . . . . 0.84999999999999998 110.336 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.97 -25.63 67.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.485 . . . . 1.95 110.27 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.7 ttp -73.05 -35.21 66.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.779 -0.646 . . . . 0.29999999999999999 110.269 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.716 HD11 HD23 ' A' ' 849' ' ' LEU . 6.0 mt -67.67 -50.76 56.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.825 -0.625 . . . . 0.46999999999999997 110.659 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.403 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.18 -2.28 36.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.11 -0.495 . . . . 0.48999999999999999 111.263 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.85 -4.92 2.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.001 0.429 . . . . 1.6799999999999999 110.211 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.403 ' H ' ' C ' ' A' ' 842' ' ' ALA . 3.1 m120 -147.67 -71.22 0.22 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.633 -0.712 . . . . 1.96 110.538 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 177.36 30.18 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.906 -0.588 . . . . 1.99 110.725 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . 0.621 ' HB3' HD23 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -96.0 142.16 28.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 2.2999999999999998 111.292 -179.602 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -136.49 -4.77 2.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.014 -0.539 . . . . 1.98 110.658 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.51 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 58.3 m-85 -91.33 136.26 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.957 -0.565 . . . . 1.0900000000000001 110.905 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.716 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -128.91 124.0 34.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.73999999999999999 111.122 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -85.46 169.14 13.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.075 -0.511 . . . . 1.52 110.851 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.706 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.0 OUTLIER -134.48 170.63 19.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.434 -0.348 . . . . 1.04 111.51 -179.699 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.82 ' HB2' ' H ' ' A' ' 817' ' ' LYS . 13.2 ttt180 -44.1 -82.55 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.134 -0.485 . . . . 5.0899999999999999 111.534 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 44.36 44.96 7.19 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.802 0.334 . . . . 2.6000000000000001 111.425 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . 0.687 ' HD2' ' HG3' ' A' ' 852' ' ' ARG . 13.2 m-85 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.293 -0.86 . . . . 3.3900000000000001 110.768 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.477 -0.249 . . . . 9.0999999999999996 112.477 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -153.08 136.19 15.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.758 0.313 . . . . 8.1199999999999992 111.036 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 2.6 ttm -138.43 139.71 39.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 8.3399999999999999 110.98 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 110.58 143.98 9.84 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.823 -0.703 . . . . 4.25 112.531 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 1.5 t -117.08 -175.67 2.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.76 0.314 . . . . 2.6099999999999999 110.958 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.09 -169.37 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.185 -0.462 . . . . 1.22 111.038 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.817 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.46 95.44 1.12 Allowed 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.999 0.428 . . . . 0.93999999999999995 110.077 179.744 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.0 OUTLIER -97.54 89.33 4.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.997 -0.547 . . . . 0.67000000000000004 111.0 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.27 137.51 32.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 1.5700000000000001 110.682 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.486 HD12 ' CE1' ' A' ' 848' ' ' PHE . 0.6 OUTLIER -62.61 107.49 0.96 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.114 0.483 . . . . 0.81000000000000005 110.45 179.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.427 ' HB ' ' O ' ' A' ' 847' ' ' LYS . 17.6 t -96.29 136.04 28.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.497 -0.774 . . . . 1.1799999999999999 110.712 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -97.3 165.32 12.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 1.3999999999999999 110.969 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.01 51.1 2.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.069 -0.514 . . . . 2.8500000000000001 110.651 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 1.5 p -164.53 -28.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.882 -0.599 . . . . 0.33000000000000002 110.605 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 26.4 m0 -47.75 130.83 14.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.608 -0.724 . . . . 0.29999999999999999 112.035 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.82 168.28 10.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.831 -0.803 . . . . 1.8899999999999999 108.831 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -53.34 -24.14 11.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.005 0.431 . . . . 0.63 110.329 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.65 ' O ' ' HG3' ' A' ' 796' ' ' MET . 17.5 m-20 -76.85 -60.61 2.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.846 -0.615 . . . . 2.0499999999999998 109.66 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -55.14 -21.83 14.64 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-O 121.093 0.473 . . . . 1.0700000000000001 109.804 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.595 HD22 ' CE2' ' A' ' 834' ' ' TRP . 40.2 tp -73.81 -60.24 2.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.535 -0.757 . . . . 0.93000000000000005 110.365 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.672 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 19.0 mm -57.1 -36.65 52.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.394 -0.821 . . . . 0.32000000000000001 111.988 -179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.65 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.2 mtt -69.59 -39.44 77.3 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.68 0.276 . . . . 1.53 110.837 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -65.34 -50.77 64.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.211 0.529 . . . . 0.38 110.05 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.551 ' O ' HG23 ' A' ' 802' ' ' ILE . 31.0 mt -61.4 -48.26 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 115.495 -0.775 . . . . 0.5 110.349 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.672 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.9 OUTLIER -56.35 -34.79 66.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.765 -0.652 . . . . 0.81000000000000005 110.952 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.96 -24.07 60.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.266 -0.425 . . . . 0.97999999999999998 110.715 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . 0.583 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -99.29 -2.21 37.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.075 -0.511 . . . . 2.25 111.419 -179.887 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.578 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.3 pp -116.13 -22.91 4.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.718 0.294 . . . . 0.75 111.533 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 55.7 p -147.61 86.39 1.6 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.344 -0.389 . . . . 1.53 110.9 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -153.7 121.83 6.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.107 -0.497 . . . . 2.8300000000000001 110.855 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 55.2 79.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 4.2000000000000002 111.119 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 62.25 -83.06 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.954 -0.566 . . . . 7.6900000000000004 111.383 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 63.85 179.41 0.16 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.285 -0.416 . . . . 6.2199999999999998 110.852 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.73 -38.92 16.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.088 -0.505 . . . . 6.8300000000000001 110.949 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -72.28 158.52 35.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 6.4100000000000001 110.985 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -124.17 132.09 71.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 4.7800000000000002 111.101 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 14.7 t 64.71 143.5 0.08 OUTLIER Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 116.061 -0.518 . . . . 1.8 111.327 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -74.23 -173.13 1.34 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.437 2.092 . . . . 0.94999999999999996 112.395 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.548 HG12 HD13 ' A' ' 802' ' ' ILE . 5.5 pt -146.55 171.32 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.276 -0.42 . . . . 1.9399999999999999 111.07 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 19.4 p -128.82 -67.3 0.79 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.193 -0.458 . . . . 1.1599999999999999 111.129 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.3 mptt -83.51 137.84 33.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.429 . . . . 2.6899999999999999 110.736 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . 0.692 HG22 ' HD3' ' A' ' 852' ' ' ARG . 0.9 OUTLIER -152.03 -178.18 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.296 -0.411 . . . . 0.83999999999999997 111.603 -179.749 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.904 ' HB2' ' HB3' ' A' ' 852' ' ' ARG . 6.8 mmtt -120.24 155.02 34.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.86 -0.609 . . . . 0.84999999999999998 110.691 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.62 ' CE1' HG23 ' A' ' 826' ' ' VAL . 5.2 p90 -136.47 174.29 10.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.468 -0.333 . . . . 0.70999999999999996 111.133 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -96.09 106.58 18.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.213 -0.449 . . . . 1.9099999999999999 111.043 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.444 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 5.7 t70 -79.31 173.3 12.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.8 -0.637 . . . . 1.8 110.938 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -79.21 33.55 0.23 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.224 -0.444 . . . . 1.6200000000000001 111.19 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -128.85 8.88 5.77 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.225 -0.443 . . . . 1.6499999999999999 110.554 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 64.22 51.89 48.93 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.86 -0.686 . . . . 0.88 112.414 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -176.03 141.13 0.44 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.146 0.498 . . . . 1.8600000000000001 110.598 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.547 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 58.9 m-85 -66.73 145.25 55.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.636 -0.711 . . . . 0.64000000000000001 110.747 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.62 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.9 OUTLIER -138.51 178.1 4.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 0.96999999999999997 110.824 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . 0.501 HG13 ' HE2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -99.1 116.46 42.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.0 0.428 . . . . 0.56000000000000005 111.326 -179.736 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 4.3 tp -82.33 108.17 15.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.8 -0.636 . . . . 0.81000000000000005 110.876 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -58.09 -69.38 1.3 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.863 -0.684 . . . . 0.81000000000000005 112.691 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . 0.471 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 3.0 p -170.07 -143.42 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 110.497 -0.186 . . . . 1.3100000000000001 110.497 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.471 ' H ' ' HB2' ' A' ' 830' ' ' SER . 20.2 t70 -56.48 -19.17 14.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.716 0.293 . . . . 2.2000000000000002 110.831 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -70.47 -68.49 0.42 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.356 -0.384 . . . . 2.21 110.552 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.33 -12.22 28.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.399 -0.364 . . . . 0.72999999999999998 110.357 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.595 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.0 OUTLIER -82.68 -44.41 15.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.061 -0.518 . . . . 0.26000000000000001 110.363 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -35.25 80.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.049 -0.523 . . . . 1.98 109.947 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.11 -54.6 14.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.546 -0.752 . . . . 0.67000000000000004 110.079 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.82 -26.52 46.84 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.095 -0.502 . . . . 0.22 110.506 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -67.42 -50.13 60.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.075 -0.511 . . . . 0.84999999999999998 110.277 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -58.64 -24.5 61.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.938 -0.574 . . . . 1.95 110.136 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 6.7 ttp -74.86 -36.4 62.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.691 -0.686 . . . . 0.29999999999999999 110.444 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . . . . . . . . . 17.0 mt -60.7 -43.23 98.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.082 -0.508 . . . . 0.46999999999999997 110.433 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.43 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -74.3 -27.39 60.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.545 . . . . 0.48999999999999999 111.181 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.35 7.63 0.99 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.048 -0.524 . . . . 1.6799999999999999 110.708 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 842' ' ' ALA . 24.1 m-80 -148.04 17.2 1.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.062 -0.517 . . . . 1.96 110.714 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.7 t30 60.22 12.59 3.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.17 -0.468 . . . . 1.99 110.872 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.16 171.01 15.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.973 -0.558 . . . . 2.2999999999999998 111.142 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . 0.427 ' O ' ' HB ' ' A' ' 785' ' ' VAL . 0.0 OUTLIER -152.21 -37.12 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.628 -0.714 . . . . 1.98 110.244 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.486 ' CE1' HD12 ' A' ' 784' ' ' LEU . 9.8 m-85 -83.49 147.14 27.98 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.019 -0.537 . . . . 1.0900000000000001 110.783 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 782' ' ' THR . 0.6 OUTLIER -123.38 132.63 54.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.219 -0.446 . . . . 0.73999999999999999 111.026 179.74 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.477 ' ND2' HG23 ' A' ' 782' ' ' THR . 3.1 m120 -85.65 154.15 21.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 1.52 110.936 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.817 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -121.43 169.05 13.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.21 -0.45 . . . . 1.04 111.047 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.904 ' HB3' ' HB2' ' A' ' 817' ' ' LYS . 1.6 ptm180 -53.74 -95.16 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.309 -0.405 . . . . 5.0899999999999999 111.475 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 7.6 mp 54.45 22.75 4.03 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.407 -0.36 . . . . 2.6000000000000001 111.213 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 7.1 p90 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.222 -0.894 . . . . 3.3900000000000001 110.995 179.946 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.183 0 N-CA-C 112.442 -0.263 . . . . 9.0999999999999996 112.442 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -95.02 -67.14 0.87 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.847 0.356 . . . . 8.1199999999999992 111.109 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 2.6 mtt -93.7 108.53 20.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 8.3399999999999999 110.754 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 169.97 92.88 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.681 -0.771 . . . . 4.25 112.745 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 2.3 p -97.73 9.59 42.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.888 0.375 . . . . 2.6099999999999999 110.793 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.407 ' HB ' HD22 ' A' ' 850' ' ' ASN . 0.2 OUTLIER -115.43 -155.02 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.071 -0.513 . . . . 1.22 111.097 -179.849 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.881 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.79 99.58 2.01 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 109.097 -0.705 . . . . 0.93999999999999995 109.097 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.591 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -96.46 94.87 7.65 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.723 -0.671 . . . . 0.67000000000000004 110.945 -178.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.504 HD11 ' HB1' ' A' ' 797' ' ' ALA . 0.2 OUTLIER -100.23 104.84 16.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.521 -0.763 . . . . 1.5700000000000001 110.872 -179.755 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.44 114.08 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.105 -0.498 . . . . 0.81000000000000005 110.567 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.482 HG11 ' CH2' ' A' ' 834' ' ' TRP . 30.7 m -103.41 179.55 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.451 -0.795 . . . . 1.1799999999999999 111.434 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.5 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 5.1 tp10 -122.97 176.7 5.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.968 -0.56 . . . . 1.3999999999999999 110.842 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . 0.5 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 2.5 mttt -90.0 54.96 2.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 2.8500000000000001 110.751 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.4 p -171.44 -27.97 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.107 -0.497 . . . . 0.33000000000000002 111.058 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -50.33 126.13 14.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.816 -0.629 . . . . 0.29999999999999999 112.086 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.89 167.93 11.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.708 -0.849 . . . . 1.8899999999999999 108.708 178.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.465 ' O ' HG12 ' A' ' 795' ' ' ILE . 87.4 t80 -54.51 -27.15 36.11 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.659 -0.416 . . . . 0.63 110.179 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.58 ' O ' ' HG3' ' A' ' 796' ' ' MET . 30.4 m-20 -70.71 -56.49 6.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.008 -0.542 . . . . 2.0499999999999998 109.622 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.96 -31.09 66.53 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.138 -0.483 . . . . 1.0700000000000001 110.279 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.608 HD22 ' CE2' ' A' ' 834' ' ' TRP . 31.7 tp -65.86 -54.48 26.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.826 -0.625 . . . . 0.93000000000000005 110.468 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.667 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 26.8 mm -54.11 -29.89 19.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.499 -0.773 . . . . 0.32000000000000001 111.744 -179.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.58 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 5.8 mtp -69.03 -51.59 37.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.558 0.218 . . . . 1.53 110.623 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . 0.504 ' HB1' HD11 ' A' ' 783' ' ' LEU . . . -54.27 -50.85 66.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.072 0.463 . . . . 0.38 110.157 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 802' ' ' ILE . 63.6 mt -60.3 -53.37 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.63 -0.714 . . . . 0.5 110.556 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.759 HD21 ' HB3' ' A' ' 812' ' ' PRO . 0.2 OUTLIER -54.33 -27.24 34.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.482 -0.781 . . . . 0.81000000000000005 111.458 -179.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.11 -29.18 48.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.438 -0.346 . . . . 0.97999999999999998 111.099 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 801' ' ' LYS . 0.2 OUTLIER -93.14 -9.29 39.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.397 -0.365 . . . . 2.25 111.488 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.755 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.0 OUTLIER -100.75 -31.0 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.825 0.345 . . . . 0.75 111.278 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . 0.483 ' N ' HG13 ' A' ' 802' ' ' ILE . 69.0 p -135.42 65.71 1.54 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.272 -0.422 . . . . 1.53 110.817 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -65.77 173.94 2.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.476 . . . . 2.8300000000000001 111.062 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 74.7 p -87.16 20.51 2.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 4.2000000000000002 111.019 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -76.04 -5.85 48.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.168 -0.469 . . . . 7.6900000000000004 110.854 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 17.9 t30 57.43 57.7 4.24 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.059 -0.519 . . . . 6.2199999999999998 110.836 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -144.73 4.4 1.14 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.092 -0.503 . . . . 6.8300000000000001 110.873 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -154.87 131.65 10.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.146 -0.479 . . . . 6.4100000000000001 110.858 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 29.7 pt -121.63 -179.41 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.426 . . . . 4.7800000000000002 111.183 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 56.13 81.22 0.26 Allowed Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 1.8 111.064 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . 0.759 ' HB3' HD21 ' A' ' 799' ' ' ASN . 38.9 Cg_exo -57.42 169.03 2.48 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.616 2.211 . . . . 0.94999999999999996 112.392 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.619 HG12 HD13 ' A' ' 802' ' ' ILE . 5.5 mm -119.6 161.78 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.038 -0.528 . . . . 1.9399999999999999 110.822 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . 0.582 HG23 ' H ' ' A' ' 815' ' ' LYS . 0.0 OUTLIER -131.26 -62.23 0.89 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.54 -0.3 . . . . 1.1599999999999999 111.414 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . 0.582 ' H ' HG23 ' A' ' 814' ' ' THR . 0.0 OUTLIER -82.13 142.41 32.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.37 -0.377 . . . . 2.6899999999999999 110.869 -179.835 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -155.59 167.93 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.066 -0.516 . . . . 0.83999999999999997 111.267 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.458 ' HD3' ' O ' ' A' ' 826' ' ' VAL . 19.2 mmtt -105.41 149.6 25.99 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.99 -0.55 . . . . 0.84999999999999998 110.572 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.641 ' CE1' HG23 ' A' ' 826' ' ' VAL . 6.2 p90 -131.13 169.3 16.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.764 0.316 . . . . 0.70999999999999996 111.356 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -92.14 107.08 18.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.071 -0.513 . . . . 1.9099999999999999 110.884 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.409 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 13.4 t70 -79.0 173.91 12.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.737 -0.665 . . . . 1.8 110.964 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . 0.605 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 12.4 pt-20 -71.02 0.92 6.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.244 -0.434 . . . . 1.6200000000000001 111.439 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.61 13.79 32.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.399 -0.364 . . . . 1.6499999999999999 110.796 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 55.58 55.22 29.81 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.812 -0.708 . . . . 0.88 112.277 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -171.93 135.37 0.82 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.006 0.432 . . . . 1.8600000000000001 110.553 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.583 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 65.3 m-85 -63.67 131.43 47.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.879 -0.6 . . . . 0.64000000000000001 110.895 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.641 HG23 ' CE1' ' A' ' 818' ' ' TYR . 1.8 m -127.63 -179.07 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.234 -0.439 . . . . 0.96999999999999997 110.789 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 2.5 t -98.75 116.94 42.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.054 0.454 . . . . 0.56000000000000005 111.295 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.71 108.0 12.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.81000000000000005 110.689 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -56.8 -67.13 2.38 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.829 -0.7 . . . . 0.81000000000000005 112.692 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . 0.428 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -173.86 -137.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.421 -0.214 . . . . 1.3100000000000001 110.421 -179.791 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.431 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 28.3 t70 -59.88 -16.19 27.26 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.745 0.307 . . . . 2.2000000000000002 110.751 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.41 -69.43 0.4 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 2.21 110.854 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.91 -12.46 25.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.72999999999999998 110.519 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.608 ' CE2' HD22 ' A' ' 794' ' ' LEU . 3.4 t-105 -84.68 -39.67 18.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.277 -0.42 . . . . 0.26000000000000001 110.189 179.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.748 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.3 OUTLIER -70.28 -33.48 71.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 1.98 109.836 179.011 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 66.6 t -74.84 -55.9 10.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.476 -0.784 . . . . 0.67000000000000004 110.203 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -56.12 -27.27 53.32 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.211 -0.449 . . . . 0.22 110.413 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.748 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 25.5 mtmt -66.44 -51.38 57.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.005 -0.543 . . . . 0.84999999999999998 110.359 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.69 -28.22 68.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 1.95 110.178 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . 0.605 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 11.9 ttp -70.74 -36.71 73.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.715 -0.675 . . . . 0.29999999999999999 110.216 179.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.9 HD11 HD23 ' A' ' 849' ' ' LEU . 49.4 mt -67.04 -42.76 84.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.865 -0.607 . . . . 0.46999999999999997 110.914 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.431 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -72.01 -24.9 61.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.48999999999999999 111.235 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.04 6.11 1.01 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.309 -0.405 . . . . 1.6799999999999999 110.756 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 842' ' ' ALA . 65.1 m-80 -150.86 21.1 0.79 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.087 -0.506 . . . . 1.96 110.851 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.3 15.1 4.05 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.036 -0.529 . . . . 1.99 111.167 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.08 170.58 16.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.919 0.39 . . . . 2.2999999999999998 110.924 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -157.68 -22.28 0.09 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.92 -0.582 . . . . 1.98 111.272 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.591 ' HB3' HG22 ' A' ' 782' ' ' THR . 32.4 m-85 -86.4 122.49 30.43 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.841 0.353 . . . . 1.0900000000000001 111.174 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.9 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -105.86 121.45 44.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.014 -0.539 . . . . 0.73999999999999999 110.488 179.688 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.46 ' C ' HG13 ' A' ' 851' ' ' ILE . 14.1 m120 -76.82 141.27 40.75 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.457 -0.338 . . . . 1.52 111.394 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.881 HD12 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -138.44 152.51 25.34 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 CA-C-N 116.194 -0.457 . . . . 1.04 111.421 179.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.412 ' HB3' ' HD1' ' A' ' 854' ' ' TYR . 1.3 mtp180 -113.46 176.67 4.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.439 -0.346 . . . . 5.0899999999999999 110.838 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -135.3 32.86 3.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.265 -0.425 . . . . 2.6000000000000001 110.953 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . 0.412 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 2.9 p90 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.253 -0.879 . . . . 3.3900000000000001 110.829 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.175 0 N-CA-C 112.524 -0.23 . . . . 9.0999999999999996 112.524 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 59.03 -177.73 0.08 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.941 0.4 . . . . 8.1199999999999992 111.279 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.03 -10.74 58.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.022 -0.536 . . . . 8.3399999999999999 110.905 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 115.11 -23.96 11.05 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.799 -0.715 . . . . 4.25 112.315 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.59 -44.28 82.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.781 0.324 . . . . 2.6099999999999999 110.738 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.565 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 1.5 mt -121.64 161.45 22.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 1.22 111.054 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 1.056 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -142.61 86.04 1.93 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.704 -0.48 . . . . 0.93999999999999995 109.704 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.571 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 2.1 m -97.76 118.76 35.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.82 -0.627 . . . . 0.67000000000000004 111.33 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.536 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -129.65 -168.3 1.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.731 -0.668 . . . . 1.5700000000000001 111.031 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 784' ' ' LEU . 0.0 OUTLIER -108.05 119.92 40.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.685 -0.688 . . . . 0.81000000000000005 109.472 178.799 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.569 HG13 ' CE3' ' A' ' 789' ' ' TRP . 89.1 t -117.69 145.19 23.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.227 -0.442 . . . . 1.1799999999999999 111.623 -178.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 4.7 tp10 -95.15 168.31 10.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.939 -0.573 . . . . 1.3999999999999999 110.742 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . 0.411 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -85.25 16.52 3.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 2.8500000000000001 110.993 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.09 -26.18 2.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.955 -0.566 . . . . 0.33000000000000002 111.117 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . 0.569 ' CE3' HG13 ' A' ' 785' ' ' VAL . 39.2 m0 -52.85 120.36 5.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.067 -0.515 . . . . 0.29999999999999999 112.103 -179.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . 0.811 HD21 ' HB3' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -94.05 160.4 14.73 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.54 -0.911 . . . . 1.8899999999999999 108.54 178.017 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.427 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 78.3 t80 -44.48 -34.86 2.22 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.542 0.21 . . . . 0.63 111.245 -178.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.811 ' HB3' HD21 ' A' ' 790' ' ' ASN . 33.8 t70 -68.62 -51.28 44.01 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.855 -0.424 . . . . 2.0499999999999998 109.855 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . 0.606 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.9 OUTLIER -61.23 -31.73 71.52 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.176 -0.466 . . . . 1.0700000000000001 110.32 179.218 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.569 HD22 ' CE2' ' A' ' 834' ' ' TRP . 29.8 tp -65.15 -52.98 51.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.648 -0.705 . . . . 0.93000000000000005 110.198 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.693 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 31.0 mm -54.36 -28.85 19.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.535 -0.757 . . . . 0.32000000000000001 111.212 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.609 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 6.1 mtp -67.35 -50.36 60.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.688 0.28 . . . . 1.53 110.443 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -55.06 -54.34 44.29 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.067 0.46 . . . . 0.38 110.144 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 65.4 mt -56.73 -51.01 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-N 115.765 -0.652 . . . . 0.5 110.394 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.693 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.8 OUTLIER -56.48 -26.66 54.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.536 -0.756 . . . . 0.81000000000000005 111.319 -179.764 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . 0.571 ' HA ' ' HB2' ' A' ' 804' ' ' ASN . 0.5 OUTLIER -79.75 -24.64 41.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.372 -0.376 . . . . 0.97999999999999998 111.194 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . 0.452 ' HB3' ' CE2' ' A' ' 781' ' ' PHE . 1.2 mptt -100.02 -6.78 25.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 2.25 111.334 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.592 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.4 pp -109.05 -32.45 2.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.771 0.32 . . . . 0.75 111.412 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . 0.563 ' HB2' HD12 ' A' ' 802' ' ' ILE . 0.8 OUTLIER -152.78 79.5 1.21 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.383 -0.371 . . . . 1.53 111.088 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . 0.571 ' HB2' ' HA ' ' A' ' 800' ' ' SER . 0.6 OUTLIER -169.83 92.93 0.24 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.195 -0.457 . . . . 2.8300000000000001 111.037 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -157.83 -69.53 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.167 -0.47 . . . . 4.2000000000000002 110.983 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -114.65 131.32 56.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 7.6900000000000004 110.677 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 8.6 m120 58.44 -169.17 0.13 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.148 -0.478 . . . . 6.2199999999999998 110.988 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -73.22 179.8 3.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 6.8300000000000001 110.936 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . 0.504 HD22 ' H ' ' A' ' 809' ' ' ASN . 2.3 p30 -78.66 141.1 38.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.046 -0.524 . . . . 6.4100000000000001 110.916 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 2.7 mt -88.68 -61.64 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 4.7800000000000002 111.021 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 1.8 p -159.79 81.38 2.44 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 1.8 110.838 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . 0.569 ' HB2' HD21 ' A' ' 799' ' ' ASN . 42.8 Cg_endo -67.99 -162.34 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.541 2.16 . . . . 0.94999999999999996 112.215 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.452 HD12 HG22 ' A' ' 816' ' ' ILE . 9.4 pt -140.18 162.68 24.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.344 -0.389 . . . . 1.9399999999999999 111.155 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 5.8 p -129.09 -43.36 1.33 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.182 -0.463 . . . . 1.1599999999999999 111.156 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.94 114.99 22.08 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.258 -0.428 . . . . 2.6899999999999999 110.925 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . 0.579 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -135.75 176.18 8.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.267 -0.424 . . . . 0.83999999999999997 111.443 -179.847 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.525 ' HE2' HG22 ' A' ' 827' ' ' VAL . 12.3 mmtt -128.16 136.39 51.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.959 -0.564 . . . . 0.84999999999999998 110.403 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.616 ' CE1' HG23 ' A' ' 826' ' ' VAL . 3.7 p90 -116.35 177.99 4.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.92 0.391 . . . . 0.70999999999999996 111.421 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . 0.481 HE21 ' HA2' ' A' ' 823' ' ' GLY . 11.2 tp60 -100.1 111.3 23.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.001 -0.545 . . . . 1.9099999999999999 110.741 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.443 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 6.5 t70 -79.37 175.17 10.84 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.681 -0.691 . . . . 1.8 110.953 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.37 40.19 0.56 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.252 -0.431 . . . . 1.6200000000000001 111.09 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -140.28 15.7 2.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.342 -0.39 . . . . 1.6499999999999999 110.781 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . 0.481 ' HA2' HE21 ' A' ' 819' ' ' GLN . . . 58.3 54.13 40.15 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.81 -0.71 . . . . 0.88 112.23 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -172.75 133.51 0.58 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.925 0.393 . . . . 1.8600000000000001 110.658 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.534 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 67.0 m-85 -66.37 142.77 57.5 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.013 -0.54 . . . . 0.64000000000000001 110.704 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.616 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.3 OUTLIER -133.42 172.34 16.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 0.96999999999999997 110.714 179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . 0.525 HG22 ' HE2' ' A' ' 817' ' ' LYS . 1.8 t -98.78 113.07 32.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 0.56000000000000005 111.153 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.68 116.93 20.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.747 -0.661 . . . . 0.81000000000000005 110.896 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -65.72 -64.25 3.55 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.866 -0.683 . . . . 0.81000000000000005 112.615 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.36 -142.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.533 0.206 . . . . 1.3100000000000001 110.629 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.552 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 11.1 t70 -57.08 -15.1 4.6 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.724 0.297 . . . . 2.2000000000000002 111.168 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.468 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.0 OUTLIER -73.44 -73.62 0.21 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.438 -0.347 . . . . 2.21 111.021 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -12.49 10.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.396 -0.366 . . . . 0.72999999999999998 110.646 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.569 ' CE2' HD22 ' A' ' 794' ' ' LEU . 3.7 t-105 -85.36 -39.85 17.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.385 -0.371 . . . . 0.26000000000000001 110.145 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.736 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.1 OUTLIER -69.43 -35.42 75.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.133 0.492 . . . . 1.98 109.879 178.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 832' ' ' GLU . 25.2 t -73.46 -55.19 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.625 -0.716 . . . . 0.67000000000000004 110.071 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -55.8 -27.64 52.2 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.058 -0.519 . . . . 0.22 110.374 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.736 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.3 mtmt -66.92 -47.92 70.26 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.972 -0.558 . . . . 0.84999999999999998 110.22 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -62.64 -32.64 73.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.042 -0.526 . . . . 1.95 109.946 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -64.63 -31.32 72.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.732 -0.667 . . . . 0.29999999999999999 110.119 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.89 HD11 HD23 ' A' ' 849' ' ' LEU . 1.5 mt -72.02 -42.69 66.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.788 -0.642 . . . . 0.46999999999999997 110.814 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.422 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -69.25 -20.52 63.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.463 . . . . 0.48999999999999999 111.197 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -68.07 3.61 1.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.489 . . . . 1.6799999999999999 110.577 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.12 20.06 0.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 1.96 110.901 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 58.62 19.08 6.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 1.99 111.006 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . 0.728 ' HB3' HD23 ' A' ' 841' ' ' LEU . 2.3 mt-10 -71.59 143.03 49.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 2.2999999999999998 110.816 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' A' ' 784' ' ' LEU . 27.4 mttt -136.09 14.59 3.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 1.98 110.751 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.536 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 19.6 m-85 -119.49 128.62 54.14 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.139 -0.482 . . . . 1.0900000000000001 111.251 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.89 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -115.46 129.06 56.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.005 -0.543 . . . . 0.73999999999999999 110.724 179.821 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.447 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 3.2 m120 -94.81 142.32 27.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.089 -0.505 . . . . 1.52 111.183 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 1.056 HD12 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -134.88 172.0 16.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.52 -0.309 . . . . 1.04 111.235 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.598 ' H ' HG22 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -126.46 -32.81 2.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.703 0.287 . . . . 5.0899999999999999 111.184 179.989 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 55.26 34.04 21.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.277 -0.42 . . . . 2.6000000000000001 111.053 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 1.1 p90 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.26 -0.876 . . . . 3.3900000000000001 110.984 -179.933 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 N-CA-C 112.48 -0.248 . . . . 9.0999999999999996 112.48 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 55.77 68.55 0.85 Allowed 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.775 0.321 . . . . 8.1199999999999992 111.035 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.6 102.8 9.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 8.3399999999999999 110.822 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 104.08 167.72 25.0 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.87 -0.681 . . . . 4.25 112.447 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . 0.438 ' O ' HD22 ' A' ' 853' ' ' LEU . 0.4 OUTLIER -111.64 -59.76 1.94 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.74 0.305 . . . . 2.6099999999999999 111.088 -179.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.497 ' HA ' HD13 ' A' ' 853' ' ' LEU . 0.0 OUTLIER -128.16 -168.16 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.426 . . . . 1.22 111.097 -179.773 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.452 ' CB ' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -139.83 82.91 1.9 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.043 0.449 . . . . 0.93999999999999995 109.805 179.665 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.86 121.65 40.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.867 -0.606 . . . . 0.67000000000000004 111.458 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -112.58 -163.67 0.87 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.651 -0.704 . . . . 1.5700000000000001 110.629 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.414 HD12 ' HG3' ' A' ' 847' ' ' LYS . 0.3 OUTLIER -124.97 101.89 7.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.161 -0.472 . . . . 0.81000000000000005 110.341 179.503 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 31.4 m -93.36 165.13 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.985 -0.552 . . . . 1.1799999999999999 111.341 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.45 ' HG3' ' HE3' ' A' ' 787' ' ' LYS . 0.9 OUTLIER -116.99 175.57 5.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 1.3999999999999999 111.028 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . 0.45 ' HE3' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -89.17 54.89 3.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.181 0.515 . . . . 2.8500000000000001 110.735 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -168.31 -26.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.649 -0.705 . . . . 0.33000000000000002 110.587 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 27.3 m0 -52.08 126.11 17.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.693 -0.685 . . . . 0.29999999999999999 111.923 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . 0.534 HD22 ' HB2' ' A' ' 792' ' ' ASP . 0.1 OUTLIER -95.25 165.86 12.18 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.944 -0.761 . . . . 1.8899999999999999 108.944 178.314 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.401 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 92.0 t80 -51.42 -24.9 5.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.901 0.381 . . . . 0.63 110.297 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.64 ' O ' ' HG3' ' A' ' 796' ' ' MET . 1.5 m-20 -70.5 -62.89 1.22 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.017 -0.538 . . . . 2.0499999999999998 109.74 178.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . 0.532 ' H ' HD22 ' A' ' 790' ' ' ASN . 1.0 OUTLIER -53.34 -29.26 33.17 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.112 0.482 . . . . 1.0700000000000001 110.336 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.576 HD22 ' CE2' ' A' ' 834' ' ' TRP . 26.5 tp -67.96 -53.61 24.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.784 -0.644 . . . . 0.93000000000000005 110.235 179.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.642 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 21.9 mm -60.09 -30.9 46.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.599 -0.728 . . . . 0.32000000000000001 111.211 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.64 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 21.3 mtp -69.13 -51.79 34.82 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.339 -0.245 . . . . 1.53 110.339 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.32 -52.01 62.88 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.014 0.435 . . . . 0.38 110.067 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.501 ' O ' HG23 ' A' ' 802' ' ' ILE . 71.5 mt -58.53 -52.48 59.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.636 -0.711 . . . . 0.5 110.423 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.651 ' HA ' HG12 ' A' ' 802' ' ' ILE . 7.0 t-20 -56.64 -21.59 28.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.614 -0.721 . . . . 0.81000000000000005 111.215 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 22.3 t -79.29 -31.42 43.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.97999999999999998 110.618 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -94.91 -8.63 36.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.96 -0.564 . . . . 2.25 111.245 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.651 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.3 pt -111.03 -23.94 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.476 -0.329 . . . . 0.75 111.36 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . 0.476 ' N ' HG13 ' A' ' 802' ' ' ILE . 3.8 t -148.33 58.25 1.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 1.53 110.928 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -62.18 -49.79 74.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.151 -0.477 . . . . 2.8300000000000001 110.763 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.04 125.14 26.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 4.2000000000000002 111.139 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -91.79 -13.94 30.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 7.6900000000000004 110.9 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -99.1 177.2 5.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.124 -0.489 . . . . 6.2199999999999998 111.066 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 59.75 -92.51 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.925 -0.579 . . . . 6.8300000000000001 111.273 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -106.49 147.68 29.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.866 0.365 . . . . 6.4100000000000001 111.006 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -149.63 120.45 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.047 -0.524 . . . . 4.7800000000000002 111.073 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -159.7 79.02 2.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 1.8 110.854 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -77.26 -174.77 2.33 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.661 2.24 . . . . 0.94999999999999996 112.427 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.512 HG12 HD13 ' A' ' 802' ' ' ILE . 35.0 pt -135.77 174.34 12.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.022 -0.535 . . . . 1.9399999999999999 111.046 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . 0.566 HG23 ' H ' ' A' ' 815' ' ' LYS . 0.0 OUTLIER -146.4 -60.75 0.31 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.238 -0.437 . . . . 1.1599999999999999 111.057 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . 0.566 ' H ' HG23 ' A' ' 814' ' ' THR . 1.5 tttp -92.44 126.81 37.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.293 -0.412 . . . . 2.6899999999999999 110.464 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -154.09 179.17 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.83999999999999997 111.564 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.75 ' H ' ' HB2' ' A' ' 852' ' ' ARG . 5.9 mttt -109.42 -178.35 3.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.84999999999999998 110.215 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.468 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 15.3 p90 -156.38 164.11 38.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.716 0.293 . . . . 0.70999999999999996 111.048 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.7 OUTLIER -83.53 103.16 12.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.114 0.483 . . . . 1.9099999999999999 110.605 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -79.6 176.31 9.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.638 -0.71 . . . . 1.8 110.982 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . 0.475 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.2 OUTLIER -82.93 27.53 0.54 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 1.6200000000000001 110.954 179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.39 -0.52 14.47 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.239 -0.437 . . . . 1.6499999999999999 110.775 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 84.12 16.69 66.63 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.767 -0.73 . . . . 0.88 112.436 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -143.72 -145.41 0.17 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.743 0.306 . . . . 1.8600000000000001 110.561 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.468 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 97.4 m-85 -129.95 145.95 51.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.965 0.412 . . . . 0.64000000000000001 111.602 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.473 ' CG1' ' N ' ' A' ' 827' ' ' VAL . 10.0 t -122.55 163.99 20.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.645 -0.707 . . . . 0.96999999999999997 109.722 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . 0.473 ' N ' ' CG1' ' A' ' 826' ' ' VAL . 0.2 OUTLIER -97.65 107.52 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.065 0.459 . . . . 0.56000000000000005 111.296 -179.453 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.404 ' HG ' ' HB3' ' A' ' 833' ' ' ASP . 5.6 tt -79.6 136.8 36.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.652 -0.704 . . . . 0.81000000000000005 110.723 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -90.88 -59.39 1.41 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.654 -0.784 . . . . 0.81000000000000005 112.495 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -170.5 -141.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.358 -0.238 . . . . 1.3100000000000001 110.358 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -55.96 -23.52 32.69 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.666 0.27 . . . . 2.2000000000000002 110.896 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.585 ' O ' HG23 ' A' ' 836' ' ' VAL . 5.8 tt0 -64.88 -73.74 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.294 -0.412 . . . . 2.21 110.806 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . 0.404 ' HB3' ' HG ' ' A' ' 828' ' ' LEU . 0.4 OUTLIER -60.2 -12.59 9.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.301 -0.409 . . . . 0.72999999999999998 110.636 179.63 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.576 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.5 t-105 -81.37 -39.65 24.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.983 0.42 . . . . 0.26000000000000001 109.961 179.013 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -73.55 -28.87 62.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.999 -0.546 . . . . 1.98 109.68 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 832' ' ' GLU . 24.4 t -75.48 -53.99 14.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.585 -0.734 . . . . 0.67000000000000004 109.706 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.81 -29.63 65.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.661 -0.7 . . . . 0.22 110.457 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -67.46 -45.43 75.99 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.051 -0.522 . . . . 0.84999999999999998 110.518 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -61.76 -25.23 67.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.001 -0.545 . . . . 1.95 110.326 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . 0.475 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 18.1 ttp -75.67 -38.44 58.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.68 -0.691 . . . . 0.29999999999999999 110.418 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.686 HD11 HD23 ' A' ' 849' ' ' LEU . 12.1 mt -62.76 -53.2 57.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.044 -0.526 . . . . 0.46999999999999997 110.806 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.424 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -62.53 -22.51 66.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.48999999999999999 111.039 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -67.7 3.37 1.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.077 -0.51 . . . . 1.6799999999999999 110.661 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.454 ' HB2' ' OE2' ' A' ' 846' ' ' GLU . 0.0 OUTLIER -154.98 22.57 0.44 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.465 . . . . 1.96 110.935 -180.0 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.7 m120 58.09 19.67 6.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.1 -0.5 . . . . 1.99 111.208 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . 0.454 ' OE2' ' HB2' ' A' ' 844' ' ' ASN . 0.1 OUTLIER -82.0 148.48 28.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.296 -0.411 . . . . 2.2999999999999998 110.635 179.803 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . 0.414 ' HG3' HD12 ' A' ' 784' ' ' LEU . 0.2 OUTLIER -141.68 11.04 2.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 1.98 110.97 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.455 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 64.9 m-85 -107.18 126.3 52.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.118 -0.492 . . . . 1.0900000000000001 110.733 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.686 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -123.68 126.56 46.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.232 -0.44 . . . . 0.73999999999999999 111.09 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 21.2 m-20 -88.12 -176.3 5.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.051 -0.522 . . . . 1.52 110.732 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.452 HG13 ' CB ' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -136.17 -176.15 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.811 0.339 . . . . 1.04 111.599 -179.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.75 ' HB2' ' H ' ' A' ' 817' ' ' LYS . 7.1 ttp180 -53.51 -78.8 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 5.0899999999999999 110.846 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . 0.497 HD13 ' HA ' ' A' ' 780' ' ' ILE . 0.2 OUTLIER 43.15 51.35 5.61 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.407 -0.36 . . . . 2.6000000000000001 111.438 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . 0.505 ' HD1' ' HG2' ' A' ' 852' ' ' ARG . 4.7 m-85 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.222 -0.894 . . . . 3.3900000000000001 110.865 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.324 0 N-CA-C 112.409 -0.276 . . . . 9.0999999999999996 112.409 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 55.63 49.56 16.22 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.913 0.387 . . . . 8.1199999999999992 111.131 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 14.5 mtp -76.8 -41.34 44.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 8.3399999999999999 110.823 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 153.12 136.73 2.39 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 4.25 112.521 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.55 20.31 16.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.793 0.33 . . . . 2.6099999999999999 110.779 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.528 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER -121.27 173.68 6.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 1.22 111.151 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.506 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.13 92.32 1.42 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.128 0.49 . . . . 0.93999999999999995 110.025 179.617 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.4 96.3 8.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.818 -0.628 . . . . 0.67000000000000004 110.729 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.532 HD11 ' HG3' ' A' ' 801' ' ' LYS . 0.3 OUTLIER -99.38 132.14 44.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.674 -0.694 . . . . 1.5700000000000001 111.128 -179.365 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.551 HD12 ' HE1' ' A' ' 848' ' ' PHE . 8.5 tt -65.87 107.01 1.69 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.092 -0.504 . . . . 0.81000000000000005 110.392 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.426 HG11 ' CH2' ' A' ' 834' ' ' TRP . 28.3 m -102.01 173.92 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.053 -0.521 . . . . 1.1799999999999999 111.357 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.435 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 0.7 OUTLIER -119.4 170.33 9.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 1.3999999999999999 110.833 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . 0.435 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -83.46 14.86 3.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 2.8500000000000001 111.026 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . 0.434 HG12 ' HG2' ' A' ' 786' ' ' GLU . 1.6 p -127.35 -27.44 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.922 -0.581 . . . . 0.33000000000000002 110.909 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -47.92 125.11 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.922 -0.581 . . . . 0.29999999999999999 112.007 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.74 165.93 12.46 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.134 -0.691 . . . . 1.8899999999999999 109.134 178.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -50.98 -26.42 5.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.023 0.439 . . . . 0.63 110.213 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.643 ' O ' ' HG3' ' A' ' 796' ' ' MET . 14.0 t70 -71.89 -61.41 1.8 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.863 -0.608 . . . . 2.0499999999999998 109.577 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -53.79 -24.12 14.27 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.07 -0.514 . . . . 1.0700000000000001 110.128 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.631 HD22 ' CE2' ' A' ' 834' ' ' TRP . 32.5 tp -73.56 -57.34 4.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 0.93000000000000005 110.497 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.696 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.2 mm -58.0 -33.7 46.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.689 -0.687 . . . . 0.32000000000000001 111.901 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.643 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 3.3 mtp -72.32 -44.42 62.7 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.107 -0.237 . . . . 1.53 111.001 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -61.78 -47.29 85.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.167 0.508 . . . . 0.38 109.738 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.453 ' O ' HG23 ' A' ' 802' ' ' ILE . 17.5 mt -63.39 -49.64 81.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.478 -0.783 . . . . 0.5 110.126 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.696 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.6 OUTLIER -57.77 -23.76 53.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.838 -0.619 . . . . 0.81000000000000005 110.909 179.568 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . 0.473 ' O ' ' HB2' ' A' ' 804' ' ' ASN . 0.7 OUTLIER -80.19 -27.74 38.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.97999999999999998 110.6 179.769 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . 0.532 ' HG3' HD11 ' A' ' 783' ' ' LEU . 8.1 mmpt? -97.82 -4.18 37.31 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.052 -0.522 . . . . 2.25 111.394 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.2 pp -113.8 -31.16 2.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.7 0.286 . . . . 0.75 111.422 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . 0.402 ' N ' HG13 ' A' ' 802' ' ' ILE . 1.2 m -154.8 90.12 1.28 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.926 0.393 . . . . 1.53 111.139 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 800' ' ' SER . 9.5 t-20 -130.71 -8.94 4.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.059 -0.519 . . . . 2.8300000000000001 110.793 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . 0.53 HG22 ' H ' ' A' ' 807' ' ' ASN . 1.9 m -66.46 156.15 35.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.104 -0.498 . . . . 4.2000000000000002 111.134 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -103.88 -20.46 13.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 7.6900000000000004 110.843 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . 0.53 ' H ' HG22 ' A' ' 805' ' ' THR . 0.6 OUTLIER -79.48 137.96 37.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.118 -0.492 . . . . 6.2199999999999998 111.045 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 56.9 -166.12 0.14 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.034 -0.53 . . . . 6.8300000000000001 111.143 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -76.61 -174.96 3.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.09 -0.505 . . . . 6.4100000000000001 110.837 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . 0.479 HG13 ' H ' ' A' ' 811' ' ' SER . 2.8 pt -142.38 -50.39 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 4.7800000000000002 111.171 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . 0.479 ' H ' HG13 ' A' ' 810' ' ' ILE . 19.6 m 55.33 76.98 0.45 Allowed Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.198 -0.456 . . . . 1.8 110.995 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . 0.551 ' HB2' HD21 ' A' ' 799' ' ' ASN . 53.7 Cg_endo -69.91 -171.76 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.529 2.153 . . . . 0.94999999999999996 112.53 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.496 HG12 HD13 ' A' ' 802' ' ' ILE . 3.4 pt -145.0 163.57 13.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.162 -0.472 . . . . 1.9399999999999999 111.1 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 1.2 p -133.16 -63.01 0.78 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.313 -0.403 . . . . 1.1599999999999999 111.275 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -82.14 126.11 31.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 2.6899999999999999 110.96 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -153.53 174.88 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.83999999999999997 111.212 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.453 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 15.0 mttt -115.37 152.99 31.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.84999999999999998 110.81 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.43 ' CE2' ' HB2' ' A' ' 828' ' ' LEU . 6.9 p90 -129.35 179.26 5.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.379 -0.373 . . . . 0.70999999999999996 110.898 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . 0.529 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -92.86 115.7 28.36 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.461 0.648 . . . . 1.9099999999999999 110.748 179.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -93.18 177.45 6.05 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 114.859 -1.064 . . . . 1.8 111.132 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -78.92 13.31 1.78 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.103 -0.499 . . . . 1.6200000000000001 111.113 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.48 4.7 46.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.427 . . . . 1.6499999999999999 110.628 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 75.72 10.48 84.85 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.914 -0.66 . . . . 0.88 112.475 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.64 -149.85 0.38 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.752 0.31 . . . . 1.8600000000000001 110.472 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.41 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 48.5 m-85 -128.41 139.75 52.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.384 -0.371 . . . . 0.64000000000000001 110.913 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.453 ' C ' ' HD3' ' A' ' 817' ' ' LYS . 8.9 m -123.39 173.15 9.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.419 -0.355 . . . . 0.96999999999999997 110.745 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -98.75 123.53 51.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.036 0.446 . . . . 0.56000000000000005 111.492 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 834' ' ' TRP . 5.3 tp -81.76 109.73 16.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.81000000000000005 110.723 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -64.5 -60.72 6.7 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.811 -0.709 . . . . 0.81000000000000005 112.644 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . 0.446 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -171.23 -142.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.476 -0.194 . . . . 1.3100000000000001 110.476 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.446 ' H ' ' HB3' ' A' ' 830' ' ' SER . 6.0 p-10 -61.67 -15.4 39.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.896 0.379 . . . . 2.2000000000000002 110.91 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.472 ' O ' HG23 ' A' ' 836' ' ' VAL . 44.4 mt-10 -73.72 -68.8 0.48 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.229 -0.441 . . . . 2.21 110.784 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.18 -13.52 18.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.308 -0.405 . . . . 0.72999999999999998 110.546 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.631 ' CE2' HD22 ' A' ' 794' ' ' LEU . 2.2 t-105 -81.72 -47.48 12.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.198 -0.455 . . . . 0.26000000000000001 110.037 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.31 -32.92 74.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.982 -0.554 . . . . 1.98 109.877 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 832' ' ' GLU . 58.9 t -74.04 -53.93 16.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.474 -0.785 . . . . 0.67000000000000004 109.97 179.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -53.39 -28.43 29.36 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.03 -0.532 . . . . 0.22 110.185 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.506 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 2.0 mtpp -67.73 -47.9 68.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.765 -0.652 . . . . 0.84999999999999998 110.366 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -60.17 -28.44 67.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.073 -0.512 . . . . 1.95 110.205 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 19.4 ttp -69.92 -39.44 76.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.825 -0.625 . . . . 0.29999999999999999 110.278 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.403 HD22 ' HB3' ' A' ' 846' ' ' GLU . 26.6 mt -66.59 -48.87 68.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.923 -0.58 . . . . 0.46999999999999997 110.705 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . . . . . . . . . . . -63.02 -23.47 67.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.215 -0.448 . . . . 0.48999999999999999 110.957 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.36 -0.81 2.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.039 -0.528 . . . . 1.6799999999999999 110.452 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.41 20.36 1.71 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.8 -0.637 . . . . 1.96 110.637 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.66 25.06 14.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.976 -0.556 . . . . 1.99 111.238 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . 0.403 ' HB3' HD22 ' A' ' 841' ' ' LEU . 2.1 mm-40 -85.48 171.85 11.46 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.48 -0.327 . . . . 2.2999999999999998 110.727 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 784' ' ' LEU . 15.3 pttt -159.85 11.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.31 -0.405 . . . . 1.98 111.414 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.551 ' HE1' HD12 ' A' ' 784' ' ' LEU . 29.4 m-85 -120.83 124.39 44.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.893 0.377 . . . . 1.0900000000000001 111.068 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.53 ' HG ' ' HZ3' ' A' ' 834' ' ' TRP . 0.7 OUTLIER -101.82 116.24 32.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.06 -0.518 . . . . 0.73999999999999999 110.178 179.55 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.529 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 7.2 m120 -72.16 162.69 29.11 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.058 -0.519 . . . . 1.52 111.302 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.528 ' O ' ' HA ' ' A' ' 780' ' ' ILE . 3.5 mm -141.51 152.67 19.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.208 -0.451 . . . . 1.04 111.029 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.621 ' HB3' ' HD1' ' A' ' 854' ' ' TYR . 0.0 OUTLIER -104.84 -28.22 11.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.469 -0.332 . . . . 5.0899999999999999 110.501 179.646 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . 0.451 ' H ' HG22 ' A' ' 851' ' ' ILE . 1.0 OUTLIER 56.22 23.55 7.19 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.005 -0.543 . . . . 2.6000000000000001 111.014 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . 0.621 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.21 -0.9 . . . . 3.3900000000000001 110.961 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.133 0 N-CA-C 112.451 -0.26 . . . . 9.0999999999999996 112.451 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -136.92 131.31 32.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.885 0.374 . . . . 8.1199999999999992 111.141 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 15.1 mtt -80.83 141.58 34.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.162 -0.472 . . . . 8.3399999999999999 110.838 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -137.34 -3.54 2.13 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.852 -0.689 . . . . 4.25 112.385 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 47.9 t -103.3 104.85 15.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.744 0.307 . . . . 2.6099999999999999 110.977 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.856 ' HA ' ' HG ' ' A' ' 853' ' ' LEU . 0.2 OUTLIER -131.07 -157.71 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.276 -0.42 . . . . 1.22 111.029 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.752 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -144.37 87.15 1.86 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.089 0.471 . . . . 0.93999999999999995 110.078 179.778 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.455 HG23 ' OD1' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -98.19 91.69 5.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.655 -0.702 . . . . 0.67000000000000004 111.229 -179.336 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.17 144.61 26.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.804 -0.634 . . . . 1.5700000000000001 110.956 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.409 ' HB2' ' HE1' ' A' ' 848' ' ' PHE . 1.2 tt -85.01 114.45 22.18 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.252 -0.431 . . . . 0.81000000000000005 110.316 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.442 HG11 ' CH2' ' A' ' 834' ' ' TRP . 34.9 m -98.51 -173.69 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.92 -0.582 . . . . 1.1799999999999999 111.497 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.562 ' HG3' ' H ' ' A' ' 787' ' ' LYS . 3.9 tp10 -133.86 167.92 19.69 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.952 -0.567 . . . . 1.3999999999999999 110.676 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . 0.562 ' H ' ' HG3' ' A' ' 786' ' ' GLU . 0.0 OUTLIER -82.8 49.52 1.51 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.253 -0.43 . . . . 2.8500000000000001 110.781 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.1 p -166.09 -25.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.138 -0.483 . . . . 0.33000000000000002 110.987 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 28.8 m0 -52.65 123.86 12.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.855 -0.612 . . . . 0.29999999999999999 111.922 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . 0.473 HD22 ' HB2' ' A' ' 792' ' ' ASP . 0.0 OUTLIER -92.23 168.76 11.11 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.804 -0.813 . . . . 1.8899999999999999 108.804 178.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.428 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 63.3 t80 -53.56 -26.11 20.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.139 0.495 . . . . 0.63 110.252 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.615 ' O ' ' HG3' ' A' ' 796' ' ' MET . 2.5 m-20 -70.18 -63.72 1.03 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.694 -0.685 . . . . 2.0499999999999998 109.766 178.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . 0.439 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.4 OUTLIER -52.97 -29.8 31.11 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.223 -0.444 . . . . 1.0700000000000001 110.323 179.311 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.591 HD22 ' CE2' ' A' ' 834' ' ' TRP . 30.2 tp -66.86 -54.32 23.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.824 -0.626 . . . . 0.93000000000000005 110.429 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.67 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.9 mm -59.52 -33.06 50.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.639 -0.709 . . . . 0.32000000000000001 111.621 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.615 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 4.7 mtt -68.28 -52.78 29.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.657 0.265 . . . . 1.53 110.499 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.42 -52.89 57.93 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.203 -0.453 . . . . 0.38 110.039 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.484 ' O ' HG12 ' A' ' 802' ' ' ILE . 93.4 mt -57.05 -52.39 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.757 -0.656 . . . . 0.5 110.583 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.683 ' HA ' HG12 ' A' ' 802' ' ' ILE . 1.1 t-20 -54.68 -29.82 53.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.502 -0.772 . . . . 0.81000000000000005 111.379 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 29.5 t -75.88 -26.25 56.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.468 -0.333 . . . . 0.97999999999999998 111.017 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -101.57 -0.43 34.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.273 -0.422 . . . . 2.25 111.566 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.683 HG12 ' HA ' ' A' ' 799' ' ' ASN . 14.0 pt -117.01 -26.38 2.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.681 0.276 . . . . 0.75 111.628 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 21.6 p -121.92 34.25 5.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.979 0.419 . . . . 1.53 111.124 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -68.0 176.55 2.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.042 -0.526 . . . . 2.8300000000000001 110.951 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.44 31.17 0.83 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.11 -0.495 . . . . 4.2000000000000002 111.164 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -127.23 -27.56 2.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 7.6900000000000004 110.905 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -86.64 179.2 6.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 6.2199999999999998 110.862 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -100.05 -24.35 14.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.081 -0.509 . . . . 6.8300000000000001 110.872 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -63.09 106.08 0.8 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.309 -0.405 . . . . 6.4100000000000001 110.872 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.88 -27.29 5.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 4.7800000000000002 111.201 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 1.3 t -90.54 123.63 64.77 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.15 -0.477 . . . . 1.8 110.851 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . 0.5 ' HB2' HD21 ' A' ' 799' ' ' ASN . 68.9 Cg_endo -74.05 -179.23 4.46 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.546 2.164 . . . . 0.94999999999999996 112.284 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.492 HG13 HD12 ' A' ' 802' ' ' ILE . 2.1 mt -128.52 151.48 35.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.095 -0.502 . . . . 1.9399999999999999 111.364 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.39 -71.44 0.74 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.021 -0.536 . . . . 1.1599999999999999 110.834 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -83.88 131.62 34.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 2.6899999999999999 110.592 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.2 pp -151.61 -174.72 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.307 -0.406 . . . . 0.83999999999999997 111.448 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.59 ' H ' ' HG3' ' A' ' 852' ' ' ARG . 17.2 mttt -116.21 175.38 5.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.567 . . . . 0.84999999999999998 110.173 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.63 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 22.7 p90 -148.44 166.28 28.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.921 0.391 . . . . 0.70999999999999996 111.112 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . 0.513 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 1.9 tp60 -96.39 108.45 20.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 1.9099999999999999 110.577 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.426 ' HB3' ' CG2' ' A' ' 826' ' ' VAL . 0.1 OUTLIER -79.12 -178.2 6.03 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.756 -0.657 . . . . 1.8 111.064 -179.834 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . 0.514 ' HG2' ' HG3' ' A' ' 840' ' ' MET . 3.2 pt-20 -87.2 33.99 0.68 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.277 -0.42 . . . . 1.6200000000000001 111.59 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -139.17 14.93 2.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.36 -0.382 . . . . 1.6499999999999999 110.735 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 59.84 59.13 11.05 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.842 -0.694 . . . . 0.88 112.237 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -169.36 132.59 1.28 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.965 0.412 . . . . 1.8600000000000001 110.493 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.583 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 49.4 m-85 -73.9 126.51 30.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 0.64000000000000001 111.018 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.63 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 1.3 t -108.27 170.62 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.903 -0.59 . . . . 0.96999999999999997 111.076 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . 0.501 ' H ' HG12 ' A' ' 826' ' ' VAL . 1.4 t -99.65 107.0 19.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.33 -0.396 . . . . 0.56000000000000005 111.197 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.89 110.19 18.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.53 . . . . 0.81000000000000005 110.736 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -62.42 -65.11 3.36 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.858 -0.686 . . . . 0.81000000000000005 112.605 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 85.1 p -170.2 -131.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.495 -0.187 . . . . 1.3100000000000001 110.495 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -62.8 -11.57 18.73 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.786 0.327 . . . . 2.2000000000000002 110.906 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -79.07 -68.95 0.61 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.236 -0.438 . . . . 2.21 110.954 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.85 -11.99 21.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.297 -0.41 . . . . 0.72999999999999998 110.568 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.591 ' CE2' HD22 ' A' ' 794' ' ' LEU . 0.9 OUTLIER -81.31 -45.2 16.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.309 -0.405 . . . . 0.26000000000000001 110.019 179.267 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.69 -36.18 80.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.958 -0.564 . . . . 1.98 109.957 178.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 87.9 t -70.2 -53.88 21.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.51 -0.768 . . . . 0.67000000000000004 110.06 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.21 -25.06 58.45 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.086 -0.507 . . . . 0.22 109.981 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 1.4 mtpp -65.4 -49.34 69.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.799 -0.637 . . . . 0.84999999999999998 110.096 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.37 -27.07 67.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.866 -0.606 . . . . 1.95 110.449 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . 0.514 ' HG3' ' HG2' ' A' ' 821' ' ' GLU . 10.8 ttp -74.34 -38.23 63.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.945 -0.57 . . . . 0.29999999999999999 110.515 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.616 HD11 HD23 ' A' ' 849' ' ' LEU . 14.3 mt -63.13 -42.24 99.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.085 -0.507 . . . . 0.46999999999999997 110.757 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -68.16 -23.86 64.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.506 . . . . 0.48999999999999999 111.324 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.41 4.21 1.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 1.6799999999999999 110.639 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.445 ' H ' ' C ' ' A' ' 842' ' ' ALA . 35.5 m-80 -151.88 14.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 1.96 110.867 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.9 m120 62.25 14.9 7.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.148 -0.478 . . . . 1.99 111.291 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.04 169.61 9.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.389 . . . . 2.2999999999999998 110.864 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . 0.402 ' O ' HG22 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -151.62 -30.67 0.17 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.337 -0.392 . . . . 1.98 111.036 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.409 ' HE1' ' HB2' ' A' ' 784' ' ' LEU . 26.0 m-85 -79.53 149.51 31.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.297 -0.411 . . . . 1.0900000000000001 110.667 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.616 HD23 HD11 ' A' ' 841' ' ' LEU . 0.2 OUTLIER -136.27 114.71 11.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.219 -0.446 . . . . 0.73999999999999999 111.161 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.513 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 24.8 m-20 -72.36 173.41 8.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.292 -0.413 . . . . 1.52 110.718 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.752 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -133.77 178.0 6.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.414 -0.357 . . . . 1.04 111.492 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.653 ' H ' HG22 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -40.21 -70.59 0.1 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.011 -0.541 . . . . 5.0899999999999999 111.654 179.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . 0.856 ' HG ' ' HA ' ' A' ' 780' ' ' ILE . 0.2 OUTLIER 59.11 22.05 10.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.886 -0.597 . . . . 2.6000000000000001 109.971 -178.894 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . 0.447 ' HB2' ' HD3' ' A' ' 852' ' ' ARG . 30.1 m-85 . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.194 -0.908 . . . . 3.3900000000000001 110.819 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 112.617 -0.193 . . . . 9.0999999999999996 112.617 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 57.67 83.7 0.11 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.873 0.368 . . . . 8.1199999999999992 111.078 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 1.8 ptp -140.22 -177.45 5.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.164 -0.471 . . . . 8.3399999999999999 110.939 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 169.98 -166.19 39.45 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.796 -0.716 . . . . 4.25 112.708 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 11.4 m -104.73 131.82 51.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.804 0.335 . . . . 2.6099999999999999 111.016 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER -120.78 172.31 8.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.463 . . . . 1.22 110.792 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.563 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -153.86 89.7 1.33 Allowed 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.919 0.39 . . . . 0.93999999999999995 110.399 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.521 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.1 OUTLIER -98.36 93.17 6.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.985 -0.552 . . . . 0.67000000000000004 111.111 -179.564 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.76 161.08 14.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.69 -0.686 . . . . 1.5700000000000001 110.886 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.464 HD12 ' HB2' ' A' ' 847' ' ' LYS . 0.3 OUTLIER -96.56 111.79 23.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.81000000000000005 110.269 179.448 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.496 HG11 ' CH2' ' A' ' 834' ' ' TRP . 30.0 m -97.52 -171.41 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.101 -0.499 . . . . 1.1799999999999999 111.433 -179.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.422 ' O ' ' HD2' ' A' ' 838' ' ' LYS . 0.8 OUTLIER -138.78 170.86 15.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.045 -0.525 . . . . 1.3999999999999999 110.838 -179.771 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 15.4 mmtt -85.76 49.98 1.88 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.055 0.455 . . . . 2.8500000000000001 110.512 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.6 p -165.21 -27.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.947 -0.569 . . . . 0.33000000000000002 110.791 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 30.3 m0 -52.6 122.75 9.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.921 -0.582 . . . . 0.29999999999999999 111.85 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . 0.643 HD21 ' HB2' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -95.97 159.22 15.08 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.874 -0.787 . . . . 1.8899999999999999 108.874 178.372 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.481 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 86.4 t80 -44.52 -33.01 1.59 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.698 0.285 . . . . 0.63 111.31 -178.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.643 ' HB2' HD21 ' A' ' 790' ' ' ASN . 2.3 m-20 -69.24 -51.91 32.89 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.925 -0.398 . . . . 2.0499999999999998 109.925 178.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . 0.613 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.6 OUTLIER -61.11 -29.53 69.82 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 120.995 0.426 . . . . 1.0700000000000001 110.247 179.205 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.559 HD22 ' CE2' ' A' ' 834' ' ' TRP . 34.2 tp -67.17 -52.32 42.82 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.825 -0.625 . . . . 0.93000000000000005 110.384 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.669 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 32.8 mm -57.03 -29.09 30.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.549 -0.751 . . . . 0.32000000000000001 111.706 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.592 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 10.1 mtt -67.94 -53.43 26.35 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.668 0.271 . . . . 1.53 110.336 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.0 -54.35 36.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.144 -0.48 . . . . 0.38 110.117 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 68.5 mt -55.64 -51.1 62.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-N 115.765 -0.652 . . . . 0.5 110.356 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.669 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.9 OUTLIER -56.06 -28.45 57.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.624 -0.716 . . . . 0.81000000000000005 111.338 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 43.0 t -77.24 -23.51 51.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.278 -0.419 . . . . 0.97999999999999998 110.875 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.07 0.24 27.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 2.25 111.414 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.582 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.7 pt -120.35 -22.21 3.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.571 -0.286 . . . . 0.75 111.393 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 8.7 t -136.79 40.41 2.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.389 -0.369 . . . . 1.53 110.999 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -165.59 26.33 0.05 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.276 -0.42 . . . . 2.8300000000000001 111.022 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.91 -64.35 1.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 4.2000000000000002 110.979 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.71 170.08 12.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.295 -0.411 . . . . 7.6900000000000004 110.835 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -125.1 77.01 1.59 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 6.2199999999999998 111.008 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.17 -67.59 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 6.8300000000000001 110.89 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -129.09 138.71 52.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 6.4100000000000001 110.847 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 1.1 pt -103.38 150.41 6.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.123 -0.489 . . . . 4.7800000000000002 111.137 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -153.12 88.36 3.81 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 1.8 110.996 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -76.23 137.53 19.18 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.463 2.109 . . . . 0.94999999999999996 112.257 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.429 HG13 ' CD1' ' A' ' 802' ' ' ILE . 2.3 mt -125.64 149.26 30.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.064 -0.516 . . . . 1.9399999999999999 111.337 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 2.9 p -122.89 -44.42 2.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.996 -0.547 . . . . 1.1599999999999999 110.836 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.08 130.47 41.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 2.6899999999999999 110.712 179.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . 0.658 HG22 ' HA ' ' A' ' 853' ' ' LEU . 1.0 OUTLIER -152.08 168.54 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.972 0.415 . . . . 0.83999999999999997 111.409 -179.708 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.471 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 16.7 mmtt -113.66 136.9 52.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.784 -0.644 . . . . 0.84999999999999998 110.385 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.592 ' CE1' HG23 ' A' ' 826' ' ' VAL . 4.2 p90 -114.85 173.32 6.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.811 0.338 . . . . 0.70999999999999996 111.274 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -100.38 108.29 20.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.081 -0.509 . . . . 1.9099999999999999 110.504 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.461 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 4.1 t70 -79.08 173.6 12.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.824 -0.626 . . . . 1.8 110.829 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.11 10.09 2.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.245 -0.434 . . . . 1.6200000000000001 111.043 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.86 10.38 41.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 1.6499999999999999 110.848 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 61.71 51.73 55.46 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.859 -0.686 . . . . 0.88 112.468 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.96 141.87 0.27 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.024 0.44 . . . . 1.8600000000000001 110.429 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.49 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 63.6 m-85 -66.15 142.85 57.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.836 -0.62 . . . . 0.64000000000000001 110.488 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.592 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -133.1 173.03 15.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.219 -0.446 . . . . 0.96999999999999997 110.486 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.57 113.71 34.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.931 0.396 . . . . 0.56000000000000005 111.42 -179.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.9 tt -80.25 115.7 19.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.776 -0.647 . . . . 0.81000000000000005 110.952 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -61.52 -69.25 1.35 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.852 -0.69 . . . . 0.81000000000000005 112.549 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . 0.48 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 1.2 p -170.51 -140.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 110.442 -0.207 . . . . 1.3100000000000001 110.442 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.48 ' H ' ' HB2' ' A' ' 830' ' ' SER . 0.9 OUTLIER -55.61 -24.05 30.98 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.745 0.307 . . . . 2.2000000000000002 111.033 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -64.94 0.8 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.392 -0.367 . . . . 2.21 110.757 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.83 -13.92 28.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.72999999999999998 110.641 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.559 ' CE2' HD22 ' A' ' 794' ' ' LEU . 5.3 t-105 -86.58 -44.25 12.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.381 -0.372 . . . . 0.26000000000000001 110.192 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -64.84 -27.7 69.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.189 0.518 . . . . 1.98 109.835 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 88.4 t -82.54 -58.32 3.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.474 -0.785 . . . . 0.67000000000000004 110.108 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -52.94 -30.96 37.64 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.135 -0.484 . . . . 0.22 110.533 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' A' ' 786' ' ' GLU . 11.9 ttpt -69.66 -52.18 28.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.801 -0.636 . . . . 0.84999999999999998 109.979 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.32 -26.55 61.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.438 -0.801 . . . . 1.95 110.162 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 12.3 ttp -70.83 -40.87 72.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.772 -0.649 . . . . 0.29999999999999999 110.232 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.84 HD11 HD23 ' A' ' 849' ' ' LEU . 17.4 mt -62.27 -35.22 78.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.736 -0.665 . . . . 0.46999999999999997 110.814 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -73.82 -22.26 59.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.321 -0.399 . . . . 0.48999999999999999 111.178 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -69.77 6.27 1.22 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 1.6799999999999999 110.667 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.441 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.0 OUTLIER -154.03 22.36 0.5 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.028 -0.533 . . . . 1.96 110.852 -179.902 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 58.05 16.12 3.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.102 -0.499 . . . . 1.99 111.181 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . 0.464 ' HB3' HD22 ' A' ' 841' ' ' LEU . 3.7 mt-10 -82.72 140.39 33.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 2.2999999999999998 110.807 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . 0.464 ' HB2' HD12 ' A' ' 784' ' ' LEU . 0.1 OUTLIER -135.74 30.6 3.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 1.98 110.759 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.521 ' HB3' HG22 ' A' ' 782' ' ' THR . 8.9 m-85 -125.88 126.0 43.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.117 -0.492 . . . . 1.0900000000000001 110.889 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.84 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -115.36 117.77 31.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 0.73999999999999999 110.502 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.444 ' C ' HG12 ' A' ' 851' ' ' ILE . 1.9 m-20 -84.21 152.91 23.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.261 -0.427 . . . . 1.52 111.481 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.563 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -134.95 165.88 29.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 116.088 -0.505 . . . . 1.04 111.19 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.468 ' H ' HG22 ' A' ' 851' ' ' ILE . 6.6 ttt85 -114.15 -31.07 6.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.318 -0.401 . . . . 5.0899999999999999 110.542 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . 0.658 ' HA ' HG22 ' A' ' 816' ' ' ILE . 1.8 mp 55.83 53.85 8.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.988 -0.551 . . . . 2.6000000000000001 111.293 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 1.2 p90 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.184 -0.912 . . . . 3.3900000000000001 110.906 179.858 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 N-CA-C 112.489 -0.244 . . . . 9.0999999999999996 112.489 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -163.34 -12.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.854 0.359 . . . . 8.1199999999999992 111.111 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 4.0 ptt? -104.66 24.84 11.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 8.3399999999999999 110.994 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -151.54 163.14 29.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.637 -0.792 . . . . 4.25 112.694 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 58.68 87.22 0.08 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.917 0.389 . . . . 2.6099999999999999 111.17 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.487 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.3 OUTLIER -126.8 -166.78 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.032 -0.531 . . . . 1.22 110.702 179.949 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.797 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.2 OUTLIER -158.23 93.03 1.2 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.982 0.42 . . . . 0.93999999999999995 110.138 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.97 92.21 5.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.024 -0.535 . . . . 0.67000000000000004 110.989 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.08 139.89 30.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.741 -0.663 . . . . 1.5700000000000001 110.962 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.614 HD12 ' HE1' ' A' ' 848' ' ' PHE . 6.4 tt -72.32 104.21 3.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.935 0.398 . . . . 0.81000000000000005 110.59 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.611 HG11 ' CZ2' ' A' ' 834' ' ' TRP . 67.8 t -94.68 147.3 5.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.018 -0.537 . . . . 1.1799999999999999 111.372 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -96.06 170.82 9.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 1.3999999999999999 110.548 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.44 54.18 3.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.359 -0.382 . . . . 2.8500000000000001 110.762 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.5 p -166.75 -24.07 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.108 -0.496 . . . . 0.33000000000000002 111.036 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . 0.474 ' CE3' HG13 ' A' ' 785' ' ' VAL . 38.2 m0 -53.51 122.28 9.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.081 -0.509 . . . . 0.29999999999999999 112.034 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . 0.767 HD21 ' HB2' ' A' ' 792' ' ' ASP . 0.2 OUTLIER -95.33 158.12 15.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.613 -0.884 . . . . 1.8899999999999999 108.613 178.294 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.496 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 92.7 t80 -42.54 -33.81 0.75 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.748 0.308 . . . . 0.63 111.336 -178.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.767 ' HB2' HD21 ' A' ' 790' ' ' ASN . 1.5 m-20 -69.02 -55.01 12.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.791 -0.448 . . . . 2.0499999999999998 109.791 178.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . 0.608 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.7 OUTLIER -59.56 -29.71 68.12 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 120.974 0.416 . . . . 1.0700000000000001 110.498 179.302 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.578 HD22 ' CE2' ' A' ' 834' ' ' TRP . 32.4 tp -66.27 -52.95 42.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.897 -0.592 . . . . 0.93000000000000005 110.217 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.692 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 20.3 mm -57.26 -31.84 39.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.47 -0.786 . . . . 0.32000000000000001 111.527 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.645 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.2 mtt -68.17 -53.85 22.12 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.983 -0.287 . . . . 1.53 110.539 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -52.27 -53.68 40.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.027 0.442 . . . . 0.38 110.085 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.491 ' O ' HG12 ' A' ' 802' ' ' ILE . 94.2 mt -56.81 -53.2 45.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.668 -0.696 . . . . 0.5 110.509 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.692 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -53.52 -28.0 28.8 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.648 -0.705 . . . . 0.81000000000000005 111.285 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.07 -30.91 61.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.466 -0.334 . . . . 0.97999999999999998 111.065 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.39 0.74 45.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.326 -0.397 . . . . 2.25 111.512 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 4.1 pt -122.4 -14.65 6.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.67 0.272 . . . . 0.75 111.611 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 2.2 t -142.03 -42.05 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.773 0.321 . . . . 1.53 111.198 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 20.8 t30 57.5 -173.78 0.08 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.152 -0.476 . . . . 2.8300000000000001 111.013 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 1.5 m -121.07 -10.23 9.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 4.2000000000000002 110.941 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -128.93 149.87 50.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.077 -0.51 . . . . 7.6900000000000004 110.939 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 6.4 m120 63.99 -82.45 0.03 OUTLIER 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.972 -0.558 . . . . 6.2199999999999998 111.224 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -71.64 145.97 48.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.952 0.406 . . . . 6.8300000000000001 111.268 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -173.6 92.06 0.09 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.961 -0.563 . . . . 6.4100000000000001 110.566 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 13.0 mm -111.88 -76.85 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.266 -0.425 . . . . 4.7800000000000002 111.294 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . 0.428 ' HA ' ' HD3' ' A' ' 812' ' ' PRO . 2.0 p -164.76 122.15 1.12 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.298 -0.41 . . . . 1.8 110.911 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 811' ' ' SER . 19.0 Cg_exo -65.82 147.03 84.92 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.569 2.18 . . . . 0.94999999999999996 112.08 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 14.5 mm -110.56 152.35 12.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.455 . . . . 1.9399999999999999 111.002 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.58 -56.18 1.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 1.1599999999999999 111.162 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . 0.402 ' HE2' HG12 ' A' ' 827' ' ' VAL . 1.3 tttt -92.59 118.47 31.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.247 -0.433 . . . . 2.6899999999999999 110.872 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . 0.574 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -134.61 169.22 21.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.093 -0.503 . . . . 0.83999999999999997 111.299 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.56 ' H ' ' HB2' ' A' ' 852' ' ' ARG . 12.4 mmtt -107.64 172.26 6.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.969 -0.56 . . . . 0.84999999999999998 110.553 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.599 ' CE1' HG23 ' A' ' 826' ' ' VAL . 11.0 p90 -156.19 153.03 28.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.02 0.438 . . . . 0.70999999999999996 111.524 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -80.04 106.65 12.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.763 -0.653 . . . . 1.9099999999999999 110.694 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.412 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 6.9 t0 -78.75 178.51 7.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.552 -0.749 . . . . 1.8 110.819 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -80.11 41.58 0.53 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.227 -0.442 . . . . 1.6200000000000001 111.236 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -139.76 10.87 2.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 1.6499999999999999 110.759 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 62.9 50.15 66.28 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.852 -0.69 . . . . 0.88 112.452 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -173.96 134.95 0.47 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.985 0.421 . . . . 1.8600000000000001 110.659 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -64.17 148.41 50.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.883 -0.599 . . . . 0.64000000000000001 110.778 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.599 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -136.93 176.56 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.96999999999999997 110.642 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . 0.402 HG12 ' HE2' ' A' ' 815' ' ' LYS . 0.2 OUTLIER -99.24 110.91 27.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.914 0.387 . . . . 0.56000000000000005 111.138 -179.774 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 5.9 tt -79.69 124.07 28.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.81000000000000005 110.869 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -69.87 -66.16 2.32 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.812 -0.709 . . . . 0.81000000000000005 112.453 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -171.02 -140.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.467 0.175 . . . . 1.3100000000000001 110.617 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.429 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 1.9 p30 -58.12 -18.72 27.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.779 0.323 . . . . 2.2000000000000002 111.048 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.419 ' O ' HG23 ' A' ' 836' ' ' VAL . 2.6 mt-10 -72.23 -68.14 0.49 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.261 -0.427 . . . . 2.21 110.715 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.88 -12.27 23.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.312 -0.404 . . . . 0.72999999999999998 110.668 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.611 ' CZ2' HG11 ' A' ' 785' ' ' VAL . 2.1 t-105 -85.23 -41.8 15.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.26000000000000001 110.249 179.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.553 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -68.33 -36.7 79.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.892 -0.594 . . . . 1.98 109.489 178.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 832' ' ' GLU . 64.5 t -70.62 -55.27 14.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.354 -0.839 . . . . 0.67000000000000004 109.913 179.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.21 -24.34 53.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.953 -0.567 . . . . 0.22 110.533 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.553 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 28.7 mtmt -71.42 -49.63 39.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 0.84999999999999998 110.366 179.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 0.5 OUTLIER -61.26 -21.91 64.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.977 -0.556 . . . . 1.95 110.214 179.424 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 5.6 ttp -77.79 -36.39 50.48 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.704 -0.68 . . . . 0.29999999999999999 110.454 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.877 HD11 HD23 ' A' ' 849' ' ' LEU . 17.2 mt -66.1 -48.8 69.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 0.46999999999999997 110.629 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.446 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.81 -30.5 71.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.165 -0.47 . . . . 0.48999999999999999 111.097 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 0.7 OUTLIER -69.27 5.86 1.16 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.154 -0.476 . . . . 1.6799999999999999 110.593 179.741 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.446 ' H ' ' C ' ' A' ' 842' ' ' ALA . 9.0 m-80 -143.2 19.36 1.92 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 1.96 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 62.06 9.96 3.4 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.115 -0.493 . . . . 1.99 111.346 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.33 174.36 10.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.499 -0.319 . . . . 2.2999999999999998 110.909 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -157.65 -32.63 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 1.98 110.84 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.614 ' HE1' HD12 ' A' ' 784' ' ' LEU . 2.3 m-85 -80.27 147.95 30.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 1.0900000000000001 110.86 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.877 HD23 HD11 ' A' ' 841' ' ' LEU . 0.6 OUTLIER -125.01 128.38 48.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 0.73999999999999999 111.011 -179.857 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.524 ' O ' HD13 ' A' ' 849' ' ' LEU . 6.0 m120 -79.15 160.08 27.15 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.173 -0.467 . . . . 1.52 110.978 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.797 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.1 mm -132.54 165.67 31.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.439 -0.346 . . . . 1.04 111.63 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.56 ' HB2' ' H ' ' A' ' 817' ' ' LYS . 21.2 ttp180 -51.6 -90.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 5.0899999999999999 111.118 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . 0.446 HD12 ' HB2' ' A' ' 781' ' ' PHE . 1.3 mt 50.77 24.74 1.83 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.692 0.282 . . . . 2.6000000000000001 111.634 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . 0.431 ' H ' ' HG2' ' A' ' 852' ' ' ARG . 18.3 p90 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.247 -0.882 . . . . 3.3900000000000001 110.912 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.578 -0.209 . . . . 9.0999999999999996 112.578 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 56.63 28.7 14.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.829 0.347 . . . . 8.1199999999999992 111.2 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -155.17 106.71 2.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 8.3399999999999999 110.891 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -117.88 -173.62 16.27 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.717 -0.754 . . . . 4.25 112.529 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . 0.41 ' O ' ' HB3' ' A' ' 853' ' ' LEU . 1.4 m -118.35 10.04 12.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.931 0.396 . . . . 2.6099999999999999 110.872 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.515 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -120.72 -168.35 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 1.22 110.836 179.841 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.812 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -160.24 98.39 1.29 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.043 0.449 . . . . 0.93999999999999995 109.873 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.614 HG23 ' ND2' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -96.73 86.97 4.2 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.824 -0.626 . . . . 0.67000000000000004 110.678 -179.442 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.491 ' O ' HG23 ' A' ' 785' ' ' VAL . 0.2 OUTLIER -82.11 117.43 22.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.244 -0.889 . . . . 1.5700000000000001 110.991 -179.723 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.442 HD12 ' CE1' ' A' ' 848' ' ' PHE . 0.7 OUTLIER -63.12 110.93 2.0 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.085 0.469 . . . . 0.81000000000000005 110.299 179.672 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.72 HG11 ' HZ2' ' A' ' 834' ' ' TRP . 46.8 t -107.03 152.78 8.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.708 -0.678 . . . . 1.1799999999999999 111.703 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.402 ' N ' HG12 ' A' ' 785' ' ' VAL . 1.0 OUTLIER -101.05 172.04 7.26 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.803 -0.635 . . . . 1.3999999999999999 110.416 179.4 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.27 53.24 2.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.962 0.411 . . . . 2.8500000000000001 110.622 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.2 p -164.19 -27.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.991 -0.55 . . . . 0.33000000000000002 111.097 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . 0.559 ' CE3' HG13 ' A' ' 785' ' ' VAL . 38.3 m0 -53.23 126.01 19.54 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.092 -0.504 . . . . 0.29999999999999999 112.14 -179.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.13 170.11 9.76 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.626 -0.879 . . . . 1.8899999999999999 108.626 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.425 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 49.8 t80 -56.15 -25.27 45.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.97 0.414 . . . . 0.63 110.161 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 796' ' ' MET . 26.2 t70 -72.6 -59.82 2.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.912 -0.585 . . . . 2.0499999999999998 109.933 178.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.29 -32.68 64.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.284 -0.416 . . . . 1.0700000000000001 110.125 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.599 HD22 ' CE2' ' A' ' 834' ' ' TRP . 22.3 tp -64.31 -53.38 49.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.951 -0.568 . . . . 0.93000000000000005 110.789 179.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.694 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 17.4 mm -56.34 -30.81 31.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.768 -0.651 . . . . 0.32000000000000001 111.689 -179.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 2.6 mtt -68.85 -56.31 8.36 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.234 -0.186 . . . . 1.53 110.964 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -52.03 -51.36 57.95 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.232 0.539 . . . . 0.38 110.131 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.511 ' O ' HG12 ' A' ' 802' ' ' ILE . 79.5 mt -58.76 -52.78 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-N 115.505 -0.77 . . . . 0.5 110.797 179.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.694 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.6 t-20 -50.49 -31.73 16.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.801 -0.636 . . . . 0.81000000000000005 111.536 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.54 -34.19 67.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.441 -0.345 . . . . 0.97999999999999998 110.802 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.54 8.49 44.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 2.25 111.99 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.568 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 3.3 pt -129.14 -19.1 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 111.824 0.305 . . . . 0.75 111.824 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 1.6 m -121.54 -79.23 0.61 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.577 -0.283 . . . . 1.53 111.044 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 52.79 -164.88 0.08 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.846 0.355 . . . . 2.8300000000000001 111.178 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 3.2 t -153.72 120.32 5.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.19 -0.459 . . . . 4.2000000000000002 110.804 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -165.7 -55.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.459 . . . . 7.6900000000000004 110.95 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -95.98 -79.78 0.44 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.152 -0.477 . . . . 6.2199999999999998 111.046 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -93.18 -162.5 0.94 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.347 -0.388 . . . . 6.8300000000000001 110.849 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -66.93 -172.89 0.2 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 6.4100000000000001 110.998 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 5.0 mt -96.88 -65.4 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.1 -0.5 . . . . 4.7800000000000002 110.867 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 8.0 t 50.54 65.88 6.23 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.013 -0.54 . . . . 1.8 111.168 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . 0.413 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 35.1 Cg_exo -61.34 144.27 98.35 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.592 2.195 . . . . 0.94999999999999996 112.32 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 1.9 mt -109.48 159.58 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 1.9399999999999999 110.8 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 9.5 p -126.42 -51.17 1.51 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.433 -0.348 . . . . 1.1599999999999999 111.611 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.67 125.68 29.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.9 0.381 . . . . 2.6899999999999999 111.033 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.5 pp -146.59 160.63 10.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.83999999999999997 111.339 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.664 ' HG3' ' HD2' ' A' ' 852' ' ' ARG . 16.5 mmtt -102.51 164.12 11.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.995 -0.548 . . . . 0.84999999999999998 110.52 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.556 ' CE1' HG23 ' A' ' 826' ' ' VAL . 12.2 p90 -145.77 153.4 40.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.948 0.404 . . . . 0.70999999999999996 111.312 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . 0.471 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.6 OUTLIER -76.72 104.76 7.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.924 -0.58 . . . . 1.9099999999999999 110.751 -179.611 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.537 ' HB2' HG22 ' A' ' 826' ' ' VAL . 5.8 t70 -79.26 173.98 12.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.581 -0.736 . . . . 1.8 111.055 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . 0.454 ' HB3' ' SD ' ' A' ' 840' ' ' MET . 6.7 pt-20 -74.1 9.42 1.6 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.14 -0.482 . . . . 1.6200000000000001 111.446 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.72 14.47 29.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.386 -0.37 . . . . 1.6499999999999999 110.802 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 59.07 46.93 93.01 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.751 -0.738 . . . . 0.88 112.376 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -174.5 136.43 0.45 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.025 0.44 . . . . 1.8600000000000001 110.546 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.474 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 91.6 m-85 -63.21 140.7 58.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.751 -0.659 . . . . 0.64000000000000001 110.915 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.556 HG23 ' CE1' ' A' ' 818' ' ' TYR . 2.4 m -130.36 -179.6 3.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.082 -0.508 . . . . 0.96999999999999997 110.648 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.85 112.7 31.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.05 0.452 . . . . 0.56000000000000005 111.388 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.405 ' HB2' ' CD1' ' A' ' 818' ' ' TYR . 0.7 OUTLIER -81.52 123.89 29.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.81000000000000005 110.856 179.892 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -63.5 -65.74 2.91 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.806 -0.711 . . . . 0.81000000000000005 112.443 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . 0.423 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 2.1 p -173.97 -131.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.241 -0.281 . . . . 1.3100000000000001 110.241 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.423 ' H ' ' HB2' ' A' ' 830' ' ' SER . 4.8 p-10 -64.03 -14.24 52.82 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.811 0.338 . . . . 2.2000000000000002 110.743 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.571 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.0 OUTLIER -74.34 -69.84 0.43 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.141 -0.482 . . . . 2.21 110.697 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . 0.404 ' HB2' ' HG ' ' A' ' 828' ' ' LEU . 3.7 m-20 -59.69 -14.53 14.43 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.149 -0.478 . . . . 0.72999999999999998 110.395 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.72 ' HZ2' HG11 ' A' ' 785' ' ' VAL . 1.3 t-105 -81.18 -43.54 19.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.127 -0.488 . . . . 0.26000000000000001 110.094 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.756 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -67.3 -35.93 80.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.025 -0.534 . . . . 1.98 109.78 178.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 832' ' ' GLU . 21.8 t -71.22 -55.74 12.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.398 -0.819 . . . . 0.67000000000000004 110.274 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.75 -24.15 55.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.005 -0.543 . . . . 0.22 110.591 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.756 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 31.5 mtmt -71.95 -42.26 66.8 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.163 -0.471 . . . . 0.84999999999999998 110.293 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -65.45 -27.63 68.65 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.103 -0.498 . . . . 1.95 110.014 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . 0.454 ' SD ' ' HB3' ' A' ' 821' ' ' GLU . 12.4 ttp -72.27 -35.13 68.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.743 -0.662 . . . . 0.29999999999999999 110.343 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.713 HD11 HD23 ' A' ' 849' ' ' LEU . 50.4 mt -70.47 -51.97 25.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.816 -0.629 . . . . 0.46999999999999997 110.811 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.42 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -75.69 -0.63 21.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.48999999999999999 111.359 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -65.85 -0.75 2.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.992 0.425 . . . . 1.6799999999999999 110.299 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 842' ' ' ALA . 69.8 m-80 -150.67 -71.39 0.17 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.852 -0.613 . . . . 1.96 110.507 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.38 27.18 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.885 -0.598 . . . . 1.99 111.0 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' A' ' 841' ' ' LEU . 4.5 mt-10 -87.61 156.29 19.56 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.87 0.367 . . . . 2.2999999999999998 111.038 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -145.85 -29.07 0.42 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.039 -0.528 . . . . 1.98 110.956 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.442 ' CE1' HD12 ' A' ' 784' ' ' LEU . 36.6 m-85 -79.8 157.29 27.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.183 -0.462 . . . . 1.0900000000000001 110.922 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.713 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -141.24 126.48 18.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.73999999999999999 110.852 179.815 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.614 ' ND2' HG23 ' A' ' 782' ' ' THR . 13.9 m120 -77.47 161.2 28.13 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.362 -0.381 . . . . 1.52 111.171 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.812 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.6 OUTLIER -131.29 170.53 19.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 CA-C-N 116.346 -0.388 . . . . 1.04 111.527 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.664 ' HD2' ' HG3' ' A' ' 817' ' ' LYS . 45.7 ttt-85 -53.35 -87.23 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.235 -0.439 . . . . 5.0899999999999999 110.915 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . 0.41 ' HB3' ' O ' ' A' ' 779' ' ' SER . 0.9 OUTLIER 55.46 18.07 2.49 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.201 -0.454 . . . . 2.6000000000000001 111.455 179.757 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . 0.475 ' CD1' ' HG3' ' A' ' 852' ' ' ARG . 12.1 p90 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.211 -0.9 . . . . 3.3900000000000001 110.903 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 112.494 -0.242 . . . . 9.0999999999999996 112.494 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -81.23 110.96 17.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.735 0.302 . . . . 8.1199999999999992 111.122 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 2.3 mmm 56.82 -160.92 0.21 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.104 -0.498 . . . . 8.3399999999999999 111.04 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 122.94 -5.27 9.69 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.866 -0.683 . . . . 4.25 112.47 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . 0.423 ' O ' ' HB3' ' A' ' 853' ' ' LEU . 1.0 OUTLIER -105.74 -41.98 5.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.823 0.344 . . . . 2.6099999999999999 110.908 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.421 HG22 ' H ' ' A' ' 851' ' ' ILE . 0.1 OUTLIER -132.44 -162.51 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.135 -0.484 . . . . 1.22 110.973 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.706 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.1 OUTLIER -155.68 91.11 1.28 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.05 0.452 . . . . 0.93999999999999995 110.113 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.478 HG23 ' CG ' ' A' ' 850' ' ' ASN . 0.0 OUTLIER -98.33 92.89 5.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 0.67000000000000004 111.106 -179.414 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.64 157.77 17.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.688 -0.687 . . . . 1.5700000000000001 110.746 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.75 112.78 23.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.417 -0.356 . . . . 0.81000000000000005 110.381 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.643 HG11 ' CZ2' ' A' ' 834' ' ' TRP . 23.5 t -107.6 153.63 8.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.035 -0.53 . . . . 1.1799999999999999 111.515 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.406 ' N ' HG12 ' A' ' 785' ' ' VAL . 0.2 OUTLIER -104.82 175.37 5.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.883 -0.598 . . . . 1.3999999999999999 110.453 179.509 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -90.0 55.63 3.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.991 0.424 . . . . 2.8500000000000001 110.734 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 2.5 p -168.07 -26.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.052 -0.522 . . . . 0.33000000000000002 111.156 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . 0.575 ' CE3' HG13 ' A' ' 785' ' ' VAL . 36.1 m0 -52.42 125.42 16.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.29999999999999999 111.767 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.68 169.78 10.23 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.808 -0.812 . . . . 1.8899999999999999 108.808 178.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.448 ' O ' HG12 ' A' ' 795' ' ' ILE . 10.1 t80 -55.62 -25.02 36.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.984 0.421 . . . . 0.63 109.912 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.593 ' O ' ' HG3' ' A' ' 796' ' ' MET . 4.6 m-20 -73.22 -61.18 1.91 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.896 -0.593 . . . . 2.0499999999999998 109.679 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.94 -32.05 60.97 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 116.229 -0.441 . . . . 1.0700000000000001 110.321 179.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.569 HD22 ' CE2' ' A' ' 834' ' ' TRP . 23.2 tp -64.42 -52.78 56.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.814 -0.63 . . . . 0.93000000000000005 110.506 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.663 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 21.2 mm -59.55 -30.83 45.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.697 -0.683 . . . . 0.32000000000000001 111.571 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.593 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 3.2 mtt -68.56 -53.76 20.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.61 0.243 . . . . 1.53 110.736 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.09 -49.57 66.17 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.082 0.467 . . . . 0.38 110.285 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.409 HG22 HG12 ' A' ' 802' ' ' ILE . 56.5 mt -60.83 -52.84 56.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.623 -0.717 . . . . 0.5 110.546 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.663 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -51.81 -23.71 5.07 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.604 -0.725 . . . . 0.81000000000000005 111.548 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.46 -33.8 31.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.384 -0.371 . . . . 0.97999999999999998 110.676 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -94.81 4.17 54.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.061 -0.518 . . . . 2.25 111.454 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.576 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.1 pt -124.6 -35.04 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 111.725 0.269 . . . . 0.75 111.725 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . 0.467 ' N ' HG13 ' A' ' 802' ' ' ILE . 23.0 p -136.45 81.39 1.88 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.946 0.403 . . . . 1.53 111.071 -179.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -87.69 122.98 32.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.917 -0.583 . . . . 2.8300000000000001 110.73 179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . 0.426 HG22 ' H ' ' A' ' 806' ' ' HIS . 0.2 OUTLIER 62.98 169.45 0.14 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.225 -0.443 . . . . 4.2000000000000002 111.252 -179.748 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . 0.426 ' H ' HG22 ' A' ' 805' ' ' THR . 2.5 t-80 -80.5 -63.55 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 7.6900000000000004 110.681 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 3.5 t30 53.82 80.83 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 6.2199999999999998 110.919 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 31.9 m120 61.58 -85.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.035 -0.53 . . . . 6.8300000000000001 111.074 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -147.33 144.56 28.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.879 0.371 . . . . 6.4100000000000001 111.041 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -138.1 178.35 4.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.034 -0.53 . . . . 4.7800000000000002 111.001 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 1.5 m -137.63 88.16 16.71 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.33 -0.396 . . . . 1.8 111.234 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.22 -174.45 1.2 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.528 2.152 . . . . 0.94999999999999996 112.02 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 2.8 pt -147.79 139.07 17.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.309 -0.405 . . . . 1.9399999999999999 111.326 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 72.0 p -114.18 -46.32 3.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 1.1599999999999999 111.078 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -99.1 127.28 45.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 2.6899999999999999 110.861 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.1 pp -153.82 171.51 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.173 -0.467 . . . . 0.83999999999999997 111.229 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.678 ' HG3' ' HD3' ' A' ' 852' ' ' ARG . 13.0 mmtt -101.49 175.07 5.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.84999999999999998 110.821 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.662 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 27.5 p90 -145.6 156.75 43.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.225 -0.443 . . . . 0.70999999999999996 111.08 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . 0.523 ' HB2' ' HB2' ' A' ' 850' ' ' ASN . 0.8 OUTLIER -86.93 106.49 17.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.228 0.537 . . . . 1.9099999999999999 110.59 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -79.4 177.76 8.61 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.426 -0.806 . . . . 1.8 110.886 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . 0.507 ' HG2' ' HG3' ' A' ' 840' ' ' MET . 0.2 OUTLIER -80.69 13.2 2.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.121 -0.49 . . . . 1.6200000000000001 111.088 -179.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -99.75 -11.82 20.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 1.6499999999999999 110.743 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 94.39 11.36 57.28 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.705 -0.759 . . . . 0.88 112.618 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -128.5 -153.49 0.57 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.997 0.427 . . . . 1.8600000000000001 110.612 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.475 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 63.0 m-85 -133.26 134.94 44.58 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.918 -0.583 . . . . 0.64000000000000001 111.195 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.662 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 1.5 t -111.32 173.18 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 116.052 -0.522 . . . . 0.96999999999999997 110.946 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . 0.586 ' H ' HG12 ' A' ' 826' ' ' VAL . 6.1 t -99.45 107.06 19.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.797 0.332 . . . . 0.56000000000000005 111.074 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 7.5 tp -79.76 104.92 10.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.81000000000000005 110.672 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.11 -63.66 3.68 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.831 -0.7 . . . . 0.81000000000000005 112.712 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . 0.521 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -166.64 -142.45 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.465 0.174 . . . . 1.3100000000000001 110.571 -179.795 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.521 ' H ' ' HB3' ' A' ' 830' ' ' SER . 4.6 t0 -59.66 -14.1 12.45 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.739 0.304 . . . . 2.2000000000000002 110.925 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.405 ' O ' HG23 ' A' ' 836' ' ' VAL . 2.9 mt-10 -73.8 -70.88 0.35 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.289 -0.414 . . . . 2.21 110.733 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -63.31 -11.91 25.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.72999999999999998 110.357 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.643 ' CZ2' HG11 ' A' ' 785' ' ' VAL . 1.5 t-105 -83.1 -39.69 20.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.18 -0.464 . . . . 0.26000000000000001 109.898 179.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.719 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -69.9 -36.36 75.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.893 -0.594 . . . . 1.98 109.936 178.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 832' ' ' GLU . 44.2 t -72.01 -54.54 16.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.419 -0.81 . . . . 0.67000000000000004 110.296 179.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.39 -24.85 61.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.099 -0.501 . . . . 0.22 110.462 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.719 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.0 mtmt -69.77 -43.46 72.16 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.101 -0.5 . . . . 0.84999999999999998 110.367 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -64.41 -26.21 68.36 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 1.95 110.031 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . 0.507 ' HG3' ' HG2' ' A' ' 821' ' ' GLU . 7.6 ttp -72.92 -36.5 67.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.667 -0.697 . . . . 0.29999999999999999 110.155 179.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.592 HD11 HD23 ' A' ' 849' ' ' LEU . 3.2 mt -68.59 -44.28 74.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.585 . . . . 0.46999999999999997 110.773 179.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.423 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.46 -23.51 66.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.48999999999999999 111.179 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.8 3.81 1.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 1.6799999999999999 110.591 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 842' ' ' ALA . 38.6 m-80 -151.31 16.69 0.73 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.968 -0.56 . . . . 1.96 110.692 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 24.0 t30 58.59 19.68 6.91 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.01 -0.541 . . . . 1.99 111.102 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.16 161.06 29.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 2.2999999999999998 111.024 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -152.54 10.25 0.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 1.98 110.696 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.416 ' HB3' HG22 ' A' ' 782' ' ' THR . 74.6 m-85 -112.97 125.91 54.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.957 -0.565 . . . . 1.0900000000000001 110.765 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.592 HD23 HD11 ' A' ' 841' ' ' LEU . 0.3 OUTLIER -122.06 119.08 30.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.73999999999999999 111.002 -179.688 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.523 ' HB2' ' HB2' ' A' ' 819' ' ' GLN . 6.5 m120 -82.17 174.68 10.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 1.52 111.178 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.706 HG13 ' HB3' ' A' ' 781' ' ' PHE . 1.6 mm -133.29 165.25 32.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.165 -0.471 . . . . 1.04 111.167 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.678 ' HD3' ' HG3' ' A' ' 817' ' ' LYS . 10.3 ttp180 -47.92 -89.27 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.476 -0.329 . . . . 5.0899999999999999 111.143 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . 0.423 ' HB3' ' O ' ' A' ' 779' ' ' SER . 0.4 OUTLIER 49.79 24.4 1.25 Allowed 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.287 -0.415 . . . . 2.6000000000000001 111.47 179.917 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . 0.51 ' CD1' ' HG3' ' A' ' 852' ' ' ARG . 14.9 p90 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.302 -0.856 . . . . 3.3900000000000001 110.947 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.175 0 N-CA-C 112.479 -0.248 . . . . 9.0999999999999996 112.479 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -130.56 97.6 4.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.853 0.359 . . . . 8.1199999999999992 110.985 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.78 -32.15 2.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 8.3399999999999999 110.887 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 153.89 167.45 16.1 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.845 -0.693 . . . . 4.25 112.545 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 18.3 t -112.63 -39.75 4.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.671 0.272 . . . . 2.6099999999999999 110.968 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.34 -164.74 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.264 -0.425 . . . . 1.22 110.978 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.774 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -144.21 84.15 1.75 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.254 -0.43 . . . . 0.93999999999999995 109.971 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.524 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.3 OUTLIER -98.5 102.64 14.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.67000000000000004 111.602 -179.258 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.54 -164.87 1.19 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.009 -0.541 . . . . 1.5700000000000001 110.342 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.412 HD12 ' CE1' ' A' ' 848' ' ' PHE . 0.6 OUTLIER -119.04 108.83 15.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.012 0.434 . . . . 0.81000000000000005 110.151 179.325 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.476 HG13 ' CE3' ' A' ' 789' ' ' TRP . 90.3 t -101.88 147.11 9.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.664 -0.698 . . . . 1.1799999999999999 111.155 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -103.98 168.84 8.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.257 -0.429 . . . . 1.3999999999999999 110.953 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.82 56.53 3.93 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.193 0.52 . . . . 2.8500000000000001 110.488 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 1.7 p -164.32 -27.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.515 -0.766 . . . . 0.33000000000000002 110.49 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . 0.476 ' CE3' HG13 ' A' ' 785' ' ' VAL . 30.3 m0 -50.52 124.25 10.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.498 -0.774 . . . . 0.29999999999999999 111.897 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . 0.75 HD21 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -93.43 162.62 13.91 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.916 -0.772 . . . . 1.8899999999999999 108.916 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -44.04 -30.18 0.7 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.824 0.345 . . . . 0.63 111.395 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.75 ' HB3' HD21 ' A' ' 790' ' ' ASN . 13.1 t0 -76.69 -59.01 2.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.233 -0.44 . . . . 2.0499999999999998 110.143 179.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . 0.631 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 1.4 m-20 -53.12 -21.69 5.21 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.553 0.692 . . . . 1.0700000000000001 109.271 178.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.443 HD13 ' N ' ' A' ' 795' ' ' ILE . 1.3 tm? -74.19 -75.58 0.15 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.766 -1.106 . . . . 0.93000000000000005 109.988 178.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.631 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 23.4 mm -46.44 -32.38 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.032 -0.985 . . . . 0.32000000000000001 111.98 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.624 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 26.1 mtm -69.93 -42.23 73.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.711 0.291 . . . . 1.53 110.836 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -63.73 -47.68 80.09 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.012 0.434 . . . . 0.38 110.101 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 802' ' ' ILE . 31.2 mt -62.74 -50.23 80.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.711 -0.677 . . . . 0.5 110.176 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.659 HD21 ' H ' ' A' ' 813' ' ' ILE . 1.2 t-20 -52.19 -32.63 37.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.6 -0.727 . . . . 0.81000000000000005 111.242 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . 0.513 ' O ' ' HB2' ' A' ' 804' ' ' ASN . 0.2 OUTLIER -72.87 -32.69 65.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.97999999999999998 110.79 179.838 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . 0.457 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 4.4 mmtt -88.05 -5.06 58.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.093 -0.503 . . . . 2.25 111.374 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.631 HG12 ' HA ' ' A' ' 799' ' ' ASN . 1.3 pp -111.79 -21.65 5.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.498 -0.319 . . . . 0.75 111.423 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.07 91.28 1.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.342 -0.39 . . . . 1.53 111.085 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . 0.513 ' HB2' ' O ' ' A' ' 800' ' ' SER . 5.0 t-20 -127.47 -40.7 1.76 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.178 -0.464 . . . . 2.8300000000000001 110.843 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 44.1 p -132.08 -168.89 2.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 4.2000000000000002 110.9 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -67.86 89.42 0.28 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.289 -0.414 . . . . 7.6900000000000004 110.72 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -112.59 -163.0 0.82 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.077 -0.511 . . . . 6.2199999999999998 110.789 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -66.1 -17.9 65.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.29 -0.414 . . . . 6.8300000000000001 111.121 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -129.91 175.93 8.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 6.4100000000000001 111.056 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -137.29 -41.96 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.174 -0.466 . . . . 4.7800000000000002 111.1 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 1.4 p -80.5 133.05 56.89 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 1.8 110.775 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.24 -169.42 0.35 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.584 2.189 . . . . 0.94999999999999996 112.392 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.659 ' H ' HD21 ' A' ' 799' ' ' ASN . 11.6 pt -135.59 -178.22 2.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 1.9399999999999999 111.084 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 8.9 p -142.73 -66.32 0.39 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.093 -0.503 . . . . 1.1599999999999999 111.097 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.03 129.68 34.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.148 -0.478 . . . . 2.6899999999999999 110.66 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . 0.504 HG22 ' HD3' ' A' ' 852' ' ' ARG . 1.3 pp -146.05 161.53 11.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.065 0.459 . . . . 0.83999999999999997 111.495 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.808 ' HB2' ' HB3' ' A' ' 852' ' ' ARG . 17.5 mmtt -102.31 160.03 14.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.746 -0.661 . . . . 0.84999999999999998 110.496 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.605 ' CE1' HG23 ' A' ' 826' ' ' VAL . 11.0 p90 -145.31 156.49 43.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.973 0.416 . . . . 0.70999999999999996 111.307 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -78.59 107.01 10.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.832 -0.622 . . . . 1.9099999999999999 110.738 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.418 ' HB2' HG22 ' A' ' 826' ' ' VAL . 2.7 t0 -78.27 176.41 9.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.631 -0.713 . . . . 1.8 110.578 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -76.04 4.76 7.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.438 . . . . 1.6200000000000001 111.409 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -102.65 16.01 27.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.408 -0.36 . . . . 1.6499999999999999 110.833 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 57.73 50.56 64.41 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.822 -0.704 . . . . 0.88 112.358 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -173.1 132.89 0.51 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.794 0.331 . . . . 1.8600000000000001 110.635 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.475 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 71.6 m-85 -61.03 142.55 56.54 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.097 -0.501 . . . . 0.64000000000000001 110.682 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.605 HG23 ' CE1' ' A' ' 818' ' ' TYR . 2.4 m -134.66 179.39 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.297 -0.41 . . . . 0.96999999999999997 111.037 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -99.14 113.11 33.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.969 0.414 . . . . 0.56000000000000005 111.371 -179.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.24 120.81 24.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.825 -0.625 . . . . 0.81000000000000005 110.835 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -67.12 -68.27 1.71 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.844 -0.693 . . . . 0.81000000000000005 112.606 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -170.8 -144.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.485 -0.191 . . . . 1.3100000000000001 110.485 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -53.77 -25.03 17.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.74 0.305 . . . . 2.2000000000000002 111.081 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.502 ' O ' HG23 ' A' ' 836' ' ' VAL . 0.1 OUTLIER -66.65 -66.59 0.53 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.233 -0.439 . . . . 2.21 110.656 179.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.22 -12.14 37.89 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.277 -0.42 . . . . 0.72999999999999998 110.348 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.467 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 3.6 t-105 -81.88 -40.02 23.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.26000000000000001 109.808 178.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.698 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 11.6 m-80 -71.02 -32.04 68.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 1.98 109.883 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 832' ' ' GLU . 39.7 t -75.34 -53.77 15.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.715 -0.675 . . . . 0.67000000000000004 109.818 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -56.33 -28.11 57.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.996 -0.547 . . . . 0.22 110.315 179.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.698 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 29.1 mtmt -71.86 -48.41 46.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.854 -0.612 . . . . 0.84999999999999998 110.267 179.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.12 -22.49 66.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.944 -0.571 . . . . 1.95 110.104 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 1.2 ttp -77.54 -35.16 53.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.811 -0.631 . . . . 0.29999999999999999 110.266 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.772 HD11 HD23 ' A' ' 849' ' ' LEU . 10.2 mt -66.33 -48.86 68.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.917 -0.583 . . . . 0.46999999999999997 110.805 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.443 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.51 -29.69 70.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.414 . . . . 0.48999999999999999 111.017 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -70.63 8.59 0.82 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.984 -0.553 . . . . 1.6799999999999999 110.792 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.443 ' H ' ' C ' ' A' ' 842' ' ' ALA . 40.4 m-80 -148.55 19.63 1.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.152 -0.476 . . . . 1.96 111.005 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 62.77 10.84 4.49 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.206 -0.452 . . . . 1.99 111.064 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . 0.47 ' HB3' HD23 ' A' ' 841' ' ' LEU . 0.0 OUTLIER -86.38 147.1 26.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 2.2999999999999998 110.859 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.45 -18.91 1.45 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 1.98 110.931 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.524 ' HB3' HG22 ' A' ' 782' ' ' THR . 25.2 m-85 -87.96 147.02 25.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.278 -0.419 . . . . 1.0900000000000001 110.764 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.772 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -124.03 133.49 53.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.905 0.384 . . . . 0.73999999999999999 111.321 -179.498 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.457 ' O ' HD13 ' A' ' 849' ' ' LEU . 8.7 m120 -92.48 157.75 16.4 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.989 -0.55 . . . . 1.52 110.747 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.774 HG13 ' HB3' ' A' ' 781' ' ' PHE . 0.8 OUTLIER -122.92 167.39 16.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.465 -0.334 . . . . 1.04 111.82 -179.479 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.808 ' HB3' ' HB2' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -47.84 -73.25 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.886 -0.597 . . . . 5.0899999999999999 111.515 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 59.94 35.93 21.67 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.044 -0.525 . . . . 2.6000000000000001 110.659 -179.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.171 -0.918 . . . . 3.3900000000000001 110.799 179.922 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.098 0 N-CA-C 112.371 -0.292 . . . . 9.0999999999999996 112.371 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -94.3 -49.29 5.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.764 0.316 . . . . 8.1199999999999992 111.131 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.96 103.34 15.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.223 -0.444 . . . . 8.3399999999999999 110.715 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 173.52 131.34 1.38 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.861 -0.685 . . . . 4.25 112.41 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 853' ' ' LEU . 0.4 OUTLIER -156.15 -29.1 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.807 0.337 . . . . 2.6099999999999999 110.871 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.422 HG23 ' HZ ' ' A' ' 825' ' ' PHE . 0.0 OUTLIER -139.49 -174.74 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.238 -0.437 . . . . 1.22 110.877 -179.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 1.009 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -150.83 89.72 1.56 Allowed 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.594 -0.521 . . . . 0.93999999999999995 109.594 179.7 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.1 OUTLIER -97.99 110.6 23.15 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.816 -0.629 . . . . 0.67000000000000004 111.473 -179.013 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.524 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -110.6 -167.67 1.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.801 -0.636 . . . . 1.5700000000000001 110.606 179.765 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.57 109.24 18.67 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.027 -0.533 . . . . 0.81000000000000005 110.194 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.424 HG21 ' HH2' ' A' ' 834' ' ' TRP . 27.9 m -105.79 172.73 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 1.1799999999999999 111.462 -179.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -129.4 158.43 39.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.943 -0.571 . . . . 1.3999999999999999 110.875 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -9.56 51.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 2.8500000000000001 110.959 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.8 p -95.05 -24.97 4.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.884 -0.598 . . . . 0.33000000000000002 110.762 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 27.0 m0 -58.41 124.72 20.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.738 -0.665 . . . . 0.29999999999999999 111.854 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . 0.85 HD21 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -98.06 161.35 13.76 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.916 -0.772 . . . . 1.8899999999999999 108.916 178.394 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.46 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 53.5 t80 -44.36 -33.13 1.54 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.829 0.347 . . . . 0.63 111.138 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.85 ' HB3' HD21 ' A' ' 790' ' ' ASN . 35.7 t70 -69.52 -55.21 10.84 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.669 -0.493 . . . . 2.0499999999999998 109.669 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . 0.631 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.6 OUTLIER -58.74 -23.65 60.26 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.167 0.508 . . . . 1.0700000000000001 110.31 179.124 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.551 HD22 ' CE2' ' A' ' 834' ' ' TRP . 34.5 tp -74.05 -54.35 8.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.62 -0.718 . . . . 0.93000000000000005 110.367 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.68 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 32.0 mm -57.41 -31.45 38.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.593 -0.73 . . . . 0.32000000000000001 111.74 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.681 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 33.4 mtm -68.14 -50.23 56.0 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.965 -0.294 . . . . 1.53 110.417 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -54.72 -52.64 61.83 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.026 0.441 . . . . 0.38 109.99 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.68 -51.4 72.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.731 -0.668 . . . . 0.5 110.61 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.68 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.7 OUTLIER -57.15 -24.39 53.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.61 -0.723 . . . . 0.81000000000000005 111.199 -179.754 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 34.6 m -79.8 -26.72 40.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.108 -0.496 . . . . 0.97999999999999998 110.644 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . 0.504 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -98.91 -3.97 33.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.092 -0.503 . . . . 2.25 111.19 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.594 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.2 pt -116.69 -25.52 3.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.76 0.314 . . . . 0.75 111.437 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . 0.448 ' N ' HG13 ' A' ' 802' ' ' ILE . 0.3 OUTLIER -151.54 80.94 1.29 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 1.53 111.134 -179.844 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -170.92 -21.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.259 -0.428 . . . . 2.8300000000000001 111.204 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 2.7 t -156.39 -17.06 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.359 -0.382 . . . . 4.2000000000000002 111.355 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -106.21 134.61 49.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.33 -0.395 . . . . 7.6900000000000004 110.953 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -108.9 65.64 0.62 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.279 -0.419 . . . . 6.2199999999999998 110.935 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -108.72 0.11 20.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 6.8300000000000001 110.797 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -144.51 -168.25 2.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.963 -0.562 . . . . 6.4100000000000001 110.605 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 6.8 mt -111.02 -55.43 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.434 -0.348 . . . . 4.7800000000000002 111.296 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 32.6 m -129.63 151.47 78.1 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.351 -0.386 . . . . 1.8 110.969 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . 0.426 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 46.3 Cg_exo -56.87 175.35 0.31 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.628 2.219 . . . . 0.94999999999999996 112.161 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . . . . . . . . . 1.4 pp -138.77 158.16 30.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.296 -0.411 . . . . 1.9399999999999999 111.277 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 29.7 p -115.68 -46.35 2.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.273 -0.422 . . . . 1.1599999999999999 111.182 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -80.73 139.61 36.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 2.6899999999999999 110.706 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -153.26 175.4 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 121.022 0.439 . . . . 0.83999999999999997 111.452 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.626 ' N ' ' HG3' ' A' ' 852' ' ' ARG . 16.2 mmtt -130.88 126.54 36.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.798 -0.637 . . . . 0.84999999999999998 110.188 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.608 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 9.1 p90 -96.74 165.2 12.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.808 0.337 . . . . 0.70999999999999996 111.057 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . 0.581 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 5.6 tp60 -103.28 113.31 26.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.099 0.475 . . . . 1.9099999999999999 110.576 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -78.96 170.3 16.9 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.556 -0.747 . . . . 1.8 110.941 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.7 9.8 3.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.128 -0.487 . . . . 1.6200000000000001 111.251 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -105.72 6.61 32.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 1.6499999999999999 111.024 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 67.28 57.31 9.5 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.791 -0.719 . . . . 0.88 112.469 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -170.29 131.34 0.96 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.946 0.403 . . . . 1.8600000000000001 110.662 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.422 ' HZ ' HG23 ' A' ' 780' ' ' ILE . 34.3 m-85 -72.21 131.21 42.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.882 -0.599 . . . . 0.64000000000000001 110.942 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.608 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 0.2 OUTLIER -115.14 166.58 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 115.787 -0.642 . . . . 0.96999999999999997 111.086 -179.64 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.24 103.49 14.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 0.56000000000000005 110.618 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 3.0 tt -79.5 119.01 21.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.103 -0.499 . . . . 0.81000000000000005 110.916 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -65.58 -66.46 2.42 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.875 -0.678 . . . . 0.81000000000000005 112.775 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . 0.448 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 2.5 m -167.54 -135.16 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 110.463 -0.199 . . . . 1.3100000000000001 110.463 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.448 ' H ' ' HB3' ' A' ' 830' ' ' SER . 1.0 OUTLIER -57.81 -22.46 47.56 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.801 0.334 . . . . 2.2000000000000002 110.941 179.797 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -68.1 -70.05 0.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 2.21 110.877 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.13 -13.91 20.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.35 -0.386 . . . . 0.72999999999999998 110.511 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.551 ' CE2' HD22 ' A' ' 794' ' ' LEU . 0.4 OUTLIER -80.06 -44.96 19.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.969 -0.56 . . . . 0.26000000000000001 109.941 179.249 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.688 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 18.7 m-80 -68.11 -30.19 69.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.08 -0.509 . . . . 1.98 110.061 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 65.1 t -76.39 -56.02 9.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.735 -0.666 . . . . 0.67000000000000004 110.325 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -58.28 -27.59 64.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.006 -0.543 . . . . 0.22 110.611 179.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.688 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 25.1 mtmt -69.21 -45.27 70.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.183 -0.462 . . . . 0.84999999999999998 110.171 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.99 -26.17 65.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.079 -0.509 . . . . 1.95 110.082 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 19.8 ttp -74.54 -35.32 63.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.632 -0.713 . . . . 0.29999999999999999 110.319 179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.877 HD11 HD23 ' A' ' 849' ' ' LEU . 18.7 mt -66.67 -55.94 12.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.056 -0.52 . . . . 0.46999999999999997 110.646 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -61.44 -20.3 62.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.038 -0.528 . . . . 0.48999999999999999 111.235 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.13 2.21 1.66 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 1.6799999999999999 110.403 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.441 ' H ' ' C ' ' A' ' 842' ' ' ALA . 54.0 m-80 -153.7 23.15 0.52 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.902 -0.59 . . . . 1.96 110.769 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 1.9 t30 59.24 21.59 9.77 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.076 -0.511 . . . . 1.99 111.036 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -82.85 142.09 31.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 2.2999999999999998 110.867 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 4.05 4.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 1.98 111.044 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.524 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 4.5 m-85 -104.0 126.17 50.92 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.24 -0.436 . . . . 1.0900000000000001 110.94 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.877 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -119.06 127.66 53.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 0.73999999999999999 111.116 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.581 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 17.2 m-20 -86.0 156.21 20.54 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.962 -0.563 . . . . 1.52 110.721 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 1.009 HD12 ' HB3' ' A' ' 781' ' ' PHE . 1.7 mt -130.33 170.23 19.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.753 0.311 . . . . 1.04 111.835 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.628 ' HG2' ' HD2' ' A' ' 854' ' ' TYR . 0.5 OUTLIER -37.66 -83.44 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.9 -0.591 . . . . 5.0899999999999999 112.088 -179.422 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . 0.504 ' HB3' ' O ' ' A' ' 779' ' ' SER . 0.2 OUTLIER 55.38 36.3 26.81 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.277 -0.42 . . . . 2.6000000000000001 110.646 -179.433 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . 0.628 ' HD2' ' HG2' ' A' ' 852' ' ' ARG . 13.8 m-85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.162 -0.923 . . . . 3.3900000000000001 110.916 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.421 -0.272 . . . . 9.0999999999999996 112.421 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 56.9 89.05 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.878 0.371 . . . . 8.1199999999999992 111.245 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.21 76.45 1.58 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.172 -0.467 . . . . 8.3399999999999999 110.881 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 117.84 157.34 10.61 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.813 -0.708 . . . . 4.25 112.527 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.93 -173.99 4.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.805 0.336 . . . . 2.6099999999999999 111.031 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.494 HG22 ' H ' ' A' ' 781' ' ' PHE . 0.2 OUTLIER -120.72 -176.35 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.084 -0.507 . . . . 1.22 110.811 179.801 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.99 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.4 OUTLIER -151.82 93.92 1.91 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.497 -0.557 . . . . 0.93999999999999995 109.497 179.55 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.762 HG22 ' HB3' ' A' ' 848' ' ' PHE . 0.2 OUTLIER -97.89 99.92 11.26 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.608 -0.724 . . . . 0.67000000000000004 111.233 -178.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.492 HD11 ' HE2' ' A' ' 801' ' ' LYS . 0.4 OUTLIER -106.28 140.9 38.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.602 -0.726 . . . . 1.5700000000000001 110.572 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.47 113.77 12.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.076 0.465 . . . . 0.81000000000000005 110.489 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.419 HG11 ' HH2' ' A' ' 834' ' ' TRP . 32.7 m -106.1 -163.92 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.516 -0.766 . . . . 1.1799999999999999 111.152 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.452 ' HG2' HG12 ' A' ' 788' ' ' VAL . 0.2 OUTLIER -150.06 169.14 21.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.219 -0.446 . . . . 1.3999999999999999 111.132 -179.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.33 -10.34 59.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 2.8500000000000001 110.917 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . 0.452 HG12 ' HG2' ' A' ' 786' ' ' GLU . 2.6 p -97.64 -28.02 3.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.921 -0.581 . . . . 0.33000000000000002 110.719 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 21.2 m0 -53.36 119.06 4.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.759 -0.655 . . . . 0.29999999999999999 111.565 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.05 168.22 16.12 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.215 -0.661 . . . . 1.8899999999999999 109.215 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -53.4 -25.51 16.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.931 0.396 . . . . 0.63 110.199 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' A' ' 796' ' ' MET . 47.1 m-20 -79.97 -57.46 3.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.952 -0.567 . . . . 2.0499999999999998 109.688 178.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.01 -21.72 4.82 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.036 -0.727 . . . . 1.0700000000000001 109.036 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.489 HD13 ' N ' ' A' ' 795' ' ' ILE . 1.3 tm? -75.35 -76.44 0.15 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.827 -1.079 . . . . 0.93000000000000005 110.208 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.643 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 16.3 mm -45.52 -35.67 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.162 -0.926 . . . . 0.32000000000000001 112.072 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.634 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 20.7 mtt -67.91 -48.98 64.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.563 0.22 . . . . 1.53 110.715 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -56.55 -52.81 63.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.112 0.482 . . . . 0.38 109.965 179.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.516 ' O ' HG23 ' A' ' 802' ' ' ILE . 76.4 mt -56.93 -52.71 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.553 -0.749 . . . . 0.5 110.527 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.798 ' HA ' HG12 ' A' ' 802' ' ' ILE . 1.6 t-20 -53.2 -34.29 56.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.412 -0.813 . . . . 0.81000000000000005 111.372 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 13.3 t -69.18 -30.47 68.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.337 -0.392 . . . . 0.97999999999999998 110.941 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . 0.492 ' HE2' HD11 ' A' ' 783' ' ' LEU . 10.1 mptt -88.38 -18.42 28.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 2.25 111.42 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.798 HG12 ' HA ' ' A' ' 799' ' ' ASN . 0.9 OUTLIER -94.8 -23.84 5.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.716 0.293 . . . . 0.75 111.355 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . 0.42 ' N ' HG13 ' A' ' 802' ' ' ILE . 94.9 p -135.83 76.2 1.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.345 -0.389 . . . . 1.53 110.9 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -65.88 160.24 23.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 2.8300000000000001 110.772 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 5.4 t -76.75 157.18 31.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.261 -0.427 . . . . 4.2000000000000002 111.207 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 59.08 -167.6 0.16 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.034 -0.53 . . . . 7.6900000000000004 111.165 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 56.3 t30 59.04 -95.06 0.05 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.053 -0.521 . . . . 6.2199999999999998 111.059 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -130.35 94.64 3.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.779 0.323 . . . . 6.8300000000000001 110.979 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.84 89.57 1.85 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 6.4100000000000001 110.944 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 5.1 pt -84.62 165.97 2.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.137 -0.483 . . . . 4.7800000000000002 111.267 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 6.9 t -68.23 120.8 77.2 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.109 -0.496 . . . . 1.8 111.039 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . 0.483 ' HB3' ' OD1' ' A' ' 799' ' ' ASN . 31.2 Cg_exo -59.68 162.25 15.95 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.542 2.161 . . . . 0.94999999999999996 112.456 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.405 HG12 HD13 ' A' ' 802' ' ' ILE . 14.3 mm -115.7 153.91 17.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.123 -0.49 . . . . 1.9399999999999999 110.904 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -124.08 -68.67 0.85 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.437 -0.347 . . . . 1.1599999999999999 111.462 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.78 129.77 34.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.309 -0.405 . . . . 2.6899999999999999 110.794 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . . . . . . . . . 1.5 pp -144.75 -178.22 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.211 -0.45 . . . . 0.83999999999999997 111.409 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.616 ' HB2' ' HB2' ' A' ' 852' ' ' ARG . 15.6 mmtt -121.79 149.92 42.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.983 -0.553 . . . . 0.84999999999999998 110.488 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 825' ' ' PHE . 0.9 OUTLIER -130.98 165.05 24.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.364 . . . . 0.70999999999999996 111.299 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.05 109.13 21.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.947 -0.57 . . . . 1.9099999999999999 111.086 -179.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -79.12 167.31 21.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.566 -0.743 . . . . 1.8 110.53 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -70.06 -0.0 6.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.351 -0.386 . . . . 1.6200000000000001 111.443 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.68 13.61 33.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.446 -0.343 . . . . 1.6499999999999999 110.94 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 57.56 57.84 17.71 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.754 -0.736 . . . . 0.88 112.167 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -169.2 131.29 1.2 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 1.8600000000000001 110.708 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.496 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 57.9 m-85 -75.19 134.92 41.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.916 -0.584 . . . . 0.64000000000000001 110.974 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . . . . . . . . . 11.7 m -128.26 -177.91 2.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.96999999999999997 110.69 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 2.0 t -99.08 103.41 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.025 0.441 . . . . 0.56000000000000005 111.74 -179.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.478 ' HG ' ' HB3' ' A' ' 833' ' ' ASP . 8.7 tt -107.54 137.64 45.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.764 -0.653 . . . . 0.81000000000000005 110.379 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -179.76 32.92 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.269 -0.967 . . . . 0.81000000000000005 113.148 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.47 150.68 30.67 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.877 0.339 . . . . 1.3100000000000001 110.529 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -51.55 -21.93 2.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.014 0.435 . . . . 2.2000000000000002 110.386 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.52 ' O ' HG23 ' A' ' 836' ' ' VAL . 27.5 tt0 -71.6 -61.76 1.66 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.585 . . . . 2.21 110.967 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . 0.478 ' HB3' ' HG ' ' A' ' 828' ' ' LEU . 0.6 OUTLIER -63.45 -17.94 63.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.812 0.339 . . . . 0.72999999999999998 110.157 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.522 ' HA ' ' HE3' ' A' ' 834' ' ' TRP . 1.8 t-105 -82.4 -42.11 19.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.142 -0.481 . . . . 0.26000000000000001 110.425 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.753 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 16.6 m-80 -71.0 -30.87 67.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.098 0.475 . . . . 1.98 110.185 179.18 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 832' ' ' GLU . 91.2 t -75.74 -53.55 15.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.838 -0.619 . . . . 0.67000000000000004 110.011 179.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.84 -26.12 61.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.057 -0.519 . . . . 0.22 110.492 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.753 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 34.3 mtmt -72.46 -42.71 64.67 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.191 -0.459 . . . . 0.84999999999999998 110.32 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -64.38 -26.39 68.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.963 -0.562 . . . . 1.95 110.305 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 9.3 ttp -74.76 -39.26 61.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.791 -0.64 . . . . 0.29999999999999999 110.443 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.677 HD11 HD23 ' A' ' 849' ' ' LEU . 63.4 mt -64.49 -42.72 95.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.46999999999999997 110.845 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -65.0 -28.66 69.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.223 -0.444 . . . . 0.48999999999999999 111.074 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -70.61 6.94 1.23 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 1.6799999999999999 110.58 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.434 ' H ' ' C ' ' A' ' 842' ' ' ALA . 37.0 m-80 -148.1 14.76 1.03 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.042 -0.526 . . . . 1.96 110.911 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 59.19 18.22 6.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 1.99 111.14 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . 0.47 ' HB3' HD22 ' A' ' 841' ' ' LEU . 1.7 mm-40 -79.27 169.88 17.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.34 -0.391 . . . . 2.2999999999999998 110.936 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.8 10.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.163 -0.472 . . . . 1.98 111.195 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.762 ' HB3' HG22 ' A' ' 782' ' ' THR . 49.9 m-85 -117.23 131.68 56.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.821 0.343 . . . . 1.0900000000000001 110.629 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.677 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -110.5 123.74 50.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.73999999999999999 111.027 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -83.15 141.35 32.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.125 -0.489 . . . . 1.52 110.949 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.99 HD12 ' HB3' ' A' ' 781' ' ' PHE . 1.2 mt -133.14 151.55 34.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 116.498 -0.319 . . . . 1.04 111.821 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.616 ' HB2' ' HB2' ' A' ' 817' ' ' LYS . 0.9 OUTLIER -105.68 174.76 5.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 5.0899999999999999 110.767 179.699 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.93 40.82 3.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 2.6000000000000001 110.984 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . 0.468 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 2.6 p90 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.173 -0.917 . . . . 3.3900000000000001 110.995 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.16 0 N-CA-C 112.407 -0.277 . . . . 9.0999999999999996 112.407 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . -91.52 -55.1 3.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.8 0.333 . . . . 8.1199999999999992 111.058 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 2.0 tpt -154.6 -177.6 6.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.199 -0.455 . . . . 8.3399999999999999 110.87 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . -169.97 -108.63 0.21 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.836 -0.697 . . . . 4.25 112.495 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 55.85 70.83 0.6 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.796 0.331 . . . . 2.6099999999999999 111.07 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.27 -174.25 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 1.22 111.053 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 1.082 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -149.0 89.44 1.67 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.509 -0.552 . . . . 0.93999999999999995 109.509 179.778 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.56 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -97.53 102.2 13.9 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.911 -0.586 . . . . 0.67000000000000004 111.341 -178.889 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.54 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 8.9 mp -89.48 -176.37 5.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.544 -0.753 . . . . 1.5700000000000001 110.637 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.77 95.04 5.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.829 -0.623 . . . . 0.81000000000000005 109.523 178.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.59 HG11 ' CZ2' ' A' ' 834' ' ' TRP . 93.8 t -92.76 146.52 6.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.347 -0.842 . . . . 1.1799999999999999 111.683 -178.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.405 ' HB3' HG12 ' A' ' 788' ' ' VAL . 0.1 OUTLIER -102.41 171.04 7.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.817 -0.629 . . . . 1.3999999999999999 110.629 179.688 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.32 53.55 2.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 2.8500000000000001 110.858 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . 0.405 HG12 ' HB3' ' A' ' 786' ' ' GLU . 2.7 p -163.35 -22.97 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.981 -0.554 . . . . 0.33000000000000002 110.87 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 36.6 m0 -57.07 129.55 42.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.766 -0.652 . . . . 0.29999999999999999 112.118 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.16 166.9 11.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.707 -0.849 . . . . 1.8899999999999999 108.707 178.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -54.58 -23.36 16.51 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.746 -0.382 . . . . 0.63 110.076 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.594 ' O ' ' HG3' ' A' ' 796' ' ' MET . 10.0 t70 -73.24 -58.36 3.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.912 -0.585 . . . . 2.0499999999999998 109.919 178.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.39 -33.47 69.66 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 116.265 -0.425 . . . . 1.0700000000000001 110.334 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.536 HD22 ' CE2' ' A' ' 834' ' ' TRP . 24.7 tp -61.56 -51.74 67.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.832 -0.622 . . . . 0.93000000000000005 110.07 179.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.696 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 17.8 mm -57.76 -31.47 40.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.54 -0.755 . . . . 0.32000000000000001 111.252 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.594 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 11.4 mtp -67.4 -52.19 42.82 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.7 0.286 . . . . 1.53 110.504 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -53.5 -53.51 50.5 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.172 -0.467 . . . . 0.38 110.241 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.458 ' O ' HG23 ' A' ' 802' ' ' ILE . 70.3 mt -58.76 -50.16 80.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.772 -0.649 . . . . 0.5 110.768 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.696 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.1 t-20 -55.59 -27.91 52.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.702 -0.681 . . . . 0.81000000000000005 111.248 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 46.9 t -78.62 -26.14 45.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.354 -0.385 . . . . 0.97999999999999998 110.743 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . 0.502 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.0 OUTLIER -97.65 -2.03 42.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 2.25 111.298 -179.824 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.729 HD13 HG12 ' A' ' 813' ' ' ILE . 1.0 OUTLIER -113.89 -34.2 2.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.733 0.301 . . . . 0.75 111.399 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . 0.5 ' N ' HG13 ' A' ' 802' ' ' ILE . 14.7 p -124.33 -43.11 2.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 1.53 111.159 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . 0.435 ' HB3' ' H ' ' A' ' 805' ' ' THR . 0.2 OUTLIER 57.36 -91.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.095 -0.502 . . . . 2.8300000000000001 111.099 -179.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . 0.435 ' H ' ' HB3' ' A' ' 804' ' ' ASN . 0.0 OUTLIER -102.15 153.25 20.11 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.337 -0.392 . . . . 4.2000000000000002 111.229 179.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -88.92 13.06 13.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 7.6900000000000004 110.888 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -102.33 31.06 4.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 6.2199999999999998 110.928 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . 0.609 HD22 HD11 ' A' ' 810' ' ' ILE . 2.1 t30 -136.61 6.0 2.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.139 -0.482 . . . . 6.8300000000000001 110.941 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 59.24 56.9 3.65 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.181 -0.463 . . . . 6.4100000000000001 110.943 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . 0.609 HD11 HD22 ' A' ' 808' ' ' ASN . 12.0 mm -118.99 152.07 21.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.106 -0.497 . . . . 4.7800000000000002 110.87 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.11 120.94 39.29 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.459 . . . . 1.8 110.848 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -64.17 171.3 7.89 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.571 2.181 . . . . 0.94999999999999996 112.011 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.729 HG12 HD13 ' A' ' 802' ' ' ILE . 7.5 pt -132.86 -175.96 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 1.9399999999999999 111.148 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.84 -67.43 0.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.416 -0.357 . . . . 1.1599999999999999 111.465 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -79.58 119.36 22.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.421 -0.354 . . . . 2.6899999999999999 110.852 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . 0.726 ' HB ' ' HG2' ' A' ' 852' ' ' ARG . 0.2 OUTLIER -133.81 177.4 7.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.071 0.463 . . . . 0.83999999999999997 111.562 -179.591 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.757 ' H ' ' HG2' ' A' ' 852' ' ' ARG . 15.1 mmtt -115.47 166.64 11.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.668 -0.696 . . . . 0.84999999999999998 110.111 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.593 ' CE1' HG23 ' A' ' 826' ' ' VAL . 9.3 p90 -151.58 157.98 42.91 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.042 0.449 . . . . 0.70999999999999996 111.459 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . 0.557 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 1.6 tt0 -82.78 107.13 15.18 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.819 -0.628 . . . . 1.9099999999999999 110.733 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.415 ' HB2' ' CG2' ' A' ' 826' ' ' VAL . 12.8 t0 -78.69 178.17 8.07 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.6 -0.727 . . . . 1.8 110.67 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.28 35.49 0.33 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.412 -0.358 . . . . 1.6200000000000001 111.155 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.66 11.96 4.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 1.6499999999999999 110.608 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . 0.502 ' HA2' HE21 ' A' ' 819' ' ' GLN . . . 61.5 47.34 91.22 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.822 -0.704 . . . . 0.88 112.219 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -171.12 133.97 0.9 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.991 0.424 . . . . 1.8600000000000001 110.615 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.489 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 95.2 m-85 -64.12 145.21 56.32 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.891 -0.595 . . . . 0.64000000000000001 110.784 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.593 HG23 ' CE1' ' A' ' 818' ' ' TYR . 0.5 OUTLIER -132.97 177.5 7.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 0.96999999999999997 110.682 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -99.03 110.39 26.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.886 0.374 . . . . 0.56000000000000005 111.181 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.561 HD12 ' HB3' ' A' ' 833' ' ' ASP . 6.0 tp -79.93 113.84 18.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.904 -0.589 . . . . 0.81000000000000005 110.625 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -59.76 -68.88 1.47 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.934 -0.651 . . . . 0.81000000000000005 112.594 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . 0.482 ' HB3' ' H ' ' A' ' 831' ' ' ASP . 0.3 OUTLIER -171.41 -142.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.475 0.178 . . . . 1.3100000000000001 110.538 -179.834 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.482 ' H ' ' HB3' ' A' ' 830' ' ' SER . 10.3 t70 -55.18 -22.61 18.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.69 0.281 . . . . 2.2000000000000002 110.943 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . 0.576 ' O ' HG23 ' A' ' 836' ' ' VAL . 49.2 mt-10 -68.41 -70.85 0.24 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.383 -0.372 . . . . 2.21 110.737 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . 0.561 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.6 OUTLIER -60.0 -13.34 10.92 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.385 -0.37 . . . . 0.72999999999999998 110.584 179.563 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.59 ' CZ2' HG11 ' A' ' 785' ' ' VAL . 1.0 OUTLIER -79.86 -45.3 18.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.243 -0.435 . . . . 0.26000000000000001 110.014 179.172 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -67.94 -33.28 74.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.924 -0.58 . . . . 1.98 110.224 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 832' ' ' GLU . 15.7 t -73.92 -52.0 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-N 115.887 -0.597 . . . . 0.67000000000000004 109.879 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -57.97 -26.77 62.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.97 -0.559 . . . . 0.22 110.139 178.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.506 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 0.9 OUTLIER -67.79 -45.97 73.27 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.869 -0.605 . . . . 0.84999999999999998 110.348 179.513 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 843' ' ' GLU . 0.0 OUTLIER -62.51 -27.76 69.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.1 -0.5 . . . . 1.95 110.225 179.486 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 10.3 ttp -72.21 -36.69 69.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.873 -0.603 . . . . 0.29999999999999999 110.419 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.685 HD11 HD23 ' A' ' 849' ' ' LEU . 3.5 mt -73.92 -47.67 36.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.84 -0.618 . . . . 0.46999999999999997 110.833 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.429 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -63.21 -24.45 67.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.065 -0.516 . . . . 0.48999999999999999 111.047 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 839' ' ' GLU . 14.9 tt0 -65.64 -0.02 1.88 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 1.6799999999999999 110.46 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.429 ' H ' ' C ' ' A' ' 842' ' ' ALA . 9.7 m120 -145.67 17.82 1.47 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.916 -0.584 . . . . 1.96 110.681 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 4.0 m120 59.05 29.79 19.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.5 . . . . 1.99 110.887 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -84.34 156.82 21.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 2.2999999999999998 110.831 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -149.13 13.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 1.98 110.995 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.54 ' HA ' ' O ' ' A' ' 783' ' ' LEU . 79.9 m-85 -116.46 116.19 27.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 1.0900000000000001 110.765 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.685 HD23 HD11 ' A' ' 841' ' ' LEU . 0.5 OUTLIER -109.44 125.94 52.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.49 . . . . 0.73999999999999999 111.246 -179.615 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.557 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 9.6 m-20 -79.69 160.64 26.21 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.91 -0.587 . . . . 1.52 111.062 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 1.082 HD12 ' HB3' ' A' ' 781' ' ' PHE . 17.7 mt -132.41 161.88 40.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 116.49 -0.323 . . . . 1.04 111.628 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.757 ' HG2' ' H ' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -43.81 -81.32 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.258 -0.428 . . . . 5.0899999999999999 111.851 -179.488 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 56.85 45.46 21.51 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.007 0.432 . . . . 2.6000000000000001 110.465 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.259 -0.877 . . . . 3.3900000000000001 110.914 -179.811 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.547 -0.221 . . . . 9.0999999999999996 112.547 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 56.35 85.58 0.07 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.892 0.377 . . . . 8.1199999999999992 111.14 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 4.2 mmt -72.7 -47.3 48.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 8.3399999999999999 110.853 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 112.44 173.42 19.11 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.876 -0.678 . . . . 4.25 112.488 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 69.0 m -130.17 -69.34 0.67 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.362 . . . . 2.6099999999999999 110.907 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.494 ' HA ' ' O ' ' A' ' 851' ' ' ILE . 0.2 OUTLIER -121.02 172.81 7.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.086 -0.507 . . . . 1.22 111.101 -179.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 0.542 ' HB3' HG13 ' A' ' 851' ' ' ILE . 0.0 OUTLIER -149.06 87.02 1.52 Allowed 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.272 -0.422 . . . . 0.93999999999999995 110.194 179.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.2 OUTLIER -98.58 109.93 22.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.872 -0.604 . . . . 0.67000000000000004 111.31 -179.416 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 848' ' ' PHE . 0.0 OUTLIER -115.47 -167.99 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.861 -0.609 . . . . 1.5700000000000001 110.726 179.862 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.6 104.28 10.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.956 -0.566 . . . . 0.81000000000000005 110.161 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 34.7 m -96.7 175.58 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.035 -0.53 . . . . 1.1799999999999999 111.206 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.66 162.68 26.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.066 -0.516 . . . . 1.3999999999999999 110.764 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.69 2.95 10.67 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.291 -0.413 . . . . 2.8500000000000001 110.889 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . . . . . . . . . 3.3 p -109.71 -22.9 4.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.521 . . . . 0.33000000000000002 110.689 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -59.17 123.64 17.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.77 -0.65 . . . . 0.29999999999999999 111.902 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . 0.731 HD21 ' HB3' ' A' ' 792' ' ' ASP . 0.3 OUTLIER -96.49 159.76 14.76 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.854 -0.795 . . . . 1.8899999999999999 108.854 178.188 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.422 ' N ' ' HD1' ' A' ' 834' ' ' TRP . 52.0 t80 -42.68 -34.6 0.93 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.646 0.26 . . . . 0.63 111.29 -178.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.731 ' HB3' HD21 ' A' ' 790' ' ' ASN . 3.7 t0 -68.85 -55.78 10.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.835 -0.432 . . . . 2.0499999999999998 109.835 178.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . 0.595 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 1.0 OUTLIER -56.08 -25.4 45.29 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.218 0.532 . . . . 1.0700000000000001 109.961 179.078 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.575 HD22 ' CE2' ' A' ' 834' ' ' TRP . 37.0 tp -71.93 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.396 -0.82 . . . . 0.93000000000000005 110.241 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.658 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 42.2 mm -55.46 -28.17 22.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.565 -0.743 . . . . 0.32000000000000001 111.541 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.612 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 14.6 mtp -68.26 -50.95 50.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.652 0.263 . . . . 1.53 110.45 179.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -55.52 -53.46 56.15 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.026 0.441 . . . . 0.38 110.041 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 64.3 mt -56.75 -49.74 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.807 -0.633 . . . . 0.5 110.557 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.658 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 1.0 OUTLIER -54.66 -28.26 45.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.7 -0.682 . . . . 0.81000000000000005 111.273 -179.724 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 35.9 t -78.32 -27.1 47.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.41 -0.359 . . . . 0.97999999999999998 110.985 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -99.29 0.87 43.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 2.25 111.439 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.595 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.7 pp -117.34 -32.14 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.696 0.284 . . . . 0.75 111.397 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 64.0 p -135.99 80.63 1.84 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.922 0.391 . . . . 1.53 110.981 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -74.7 -62.75 1.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.042 -0.527 . . . . 2.8300000000000001 110.976 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.18 -72.51 0.12 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.241 -0.436 . . . . 4.2000000000000002 111.299 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -160.8 57.78 0.32 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 7.6900000000000004 110.949 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -155.88 -64.56 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.437 . . . . 6.2199999999999998 110.945 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -72.54 95.41 1.81 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 6.8300000000000001 110.812 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 61.29 177.68 0.11 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.122 -0.49 . . . . 6.4100000000000001 111.152 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 2.7 pt -140.83 156.42 22.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 4.7800000000000002 111.125 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 14.6 m 62.36 106.46 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 116.188 -0.46 . . . . 1.8 111.193 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.03 140.14 22.42 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.517 2.145 . . . . 0.94999999999999996 112.426 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.754 HD13 ' H ' ' A' ' 813' ' ' ILE . 0.2 OUTLIER -114.02 172.94 3.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 1.9399999999999999 111.079 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 31.2 p -126.85 -48.44 1.5 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 1.1599999999999999 111.158 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 3.5 mptt -80.69 132.05 35.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 2.6899999999999999 110.772 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . 0.541 HG22 ' HA ' ' A' ' 853' ' ' LEU . 1.1 pp -147.33 174.19 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.43 . . . . 0.83999999999999997 111.166 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.456 ' HD3' ' C ' ' A' ' 826' ' ' VAL . 16.1 mmtt -120.44 145.33 47.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.038 -0.528 . . . . 0.84999999999999998 110.752 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.607 ' CE1' HG23 ' A' ' 826' ' ' VAL . 6.0 p90 -124.72 168.54 13.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.70999999999999996 110.996 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -91.38 107.76 19.42 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.042 -0.526 . . . . 1.9099999999999999 110.798 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . 0.41 ' HB2' HG22 ' A' ' 826' ' ' VAL . 3.9 t70 -78.73 168.87 19.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.691 -0.686 . . . . 1.8 110.641 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . 0.405 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.6 OUTLIER -71.48 4.24 3.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.243 -0.435 . . . . 1.6200000000000001 111.361 -179.626 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -99.88 17.0 21.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.398 -0.365 . . . . 1.6499999999999999 110.742 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 55.9 50.51 60.83 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.848 -0.691 . . . . 0.88 112.333 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -172.97 134.6 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.928 0.394 . . . . 1.8600000000000001 110.454 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.548 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 69.3 m-85 -65.76 140.01 58.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.022 -0.536 . . . . 0.64000000000000001 110.666 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.607 HG23 ' CE1' ' A' ' 818' ' ' TYR . 3.1 m -132.48 177.24 7.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 0.96999999999999997 110.589 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.67 116.17 40.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.049 0.452 . . . . 0.56000000000000005 111.447 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.55 HD12 ' HB3' ' A' ' 833' ' ' ASP . 3.7 tp -79.76 108.05 13.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.682 -0.69 . . . . 0.81000000000000005 110.631 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -53.22 -67.14 2.28 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.928 -0.653 . . . . 0.81000000000000005 112.705 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . 0.448 ' HB2' ' H ' ' A' ' 831' ' ' ASP . 5.7 p -170.93 -141.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.488 -0.19 . . . . 1.3100000000000001 110.488 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.448 ' H ' ' HB2' ' A' ' 830' ' ' SER . 0.9 OUTLIER -56.32 -23.82 39.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.764 0.316 . . . . 2.2000000000000002 110.874 179.788 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.17 -67.94 0.41 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.445 . . . . 2.21 110.674 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . 0.55 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.2 OUTLIER -63.05 -13.29 33.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.345 -0.389 . . . . 0.72999999999999998 110.318 179.492 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.575 ' CE2' HD22 ' A' ' 794' ' ' LEU . 1.6 t-105 -80.46 -40.8 25.55 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.716 -0.476 . . . . 0.26000000000000001 109.716 178.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.402 ' HA ' ' HE2' ' A' ' 838' ' ' LYS . 31.4 m-80 -76.49 -26.67 55.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.803 -0.635 . . . . 1.98 110.132 178.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -79.4 -42.76 23.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.831 -0.622 . . . . 0.67000000000000004 109.737 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.19 71.32 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.159 0.504 . . . . 0.22 109.823 178.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 834' ' ' TRP . 0.6 OUTLIER -66.7 -48.22 69.94 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.631 -0.713 . . . . 0.84999999999999998 110.447 179.416 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -60.15 -27.63 67.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.066 -0.516 . . . . 1.95 110.512 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . 0.405 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 8.0 ttp -72.89 -38.21 67.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.952 -0.567 . . . . 0.29999999999999999 110.487 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.875 HD11 HD23 ' A' ' 849' ' ' LEU . 7.8 mt -72.77 -18.03 61.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.46999999999999997 110.905 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.433 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -78.92 -29.21 44.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.48999999999999999 111.339 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.11 1.08 1.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 1.6799999999999999 110.752 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.433 ' H ' ' C ' ' A' ' 842' ' ' ALA . 0.1 OUTLIER -144.82 13.31 1.49 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 1.96 110.855 -179.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 58.4 18.83 5.89 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.156 -0.475 . . . . 1.99 111.065 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.25 166.66 23.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 2.2999999999999998 110.901 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.16 16.38 0.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 1.98 111.02 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.486 ' HB3' HG22 ' A' ' 782' ' ' THR . 68.6 m-85 -112.48 113.11 25.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 1.0900000000000001 110.723 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.875 HD23 HD11 ' A' ' 841' ' ' LEU . 0.2 OUTLIER -100.9 130.58 46.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.73999999999999999 110.937 -179.75 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.45 ' C ' HG12 ' A' ' 851' ' ' ILE . 3.7 m-20 -96.11 153.98 17.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.187 -0.461 . . . . 1.52 111.324 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 0.548 HG22 ' H ' ' A' ' 853' ' ' LEU . 0.8 OUTLIER -135.12 166.14 28.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.069 -0.514 . . . . 1.04 111.066 179.899 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.554 ' HB3' ' HD1' ' A' ' 854' ' ' TYR . 0.1 OUTLIER -120.25 -16.15 8.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.77 0.319 . . . . 5.0899999999999999 110.887 179.682 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . 0.548 ' H ' HG22 ' A' ' 851' ' ' ILE . 4.5 mm? 56.86 35.12 25.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 2.6000000000000001 111.394 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . 0.554 ' HD1' ' HB3' ' A' ' 852' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.283 -0.865 . . . . 3.3900000000000001 110.904 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 112.459 -0.256 . . . . 9.0999999999999996 112.459 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 776' ' ' ALA . . . . . . . . . . . . . . . 57.53 -161.12 0.23 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.845 0.355 . . . . 8.1199999999999992 111.163 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 777' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -82.94 89.54 6.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.147 -0.479 . . . . 8.3399999999999999 110.744 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 778' ' ' GLY . . . . . . . . . . . . . . . 112.03 118.08 3.64 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.933 -0.651 . . . . 4.25 112.4 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 779' ' ' SER . . . . . 0.402 ' H ' ' H ' ' A' ' 780' ' ' ILE . 4.8 t -160.66 -16.77 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.837 0.351 . . . . 2.6099999999999999 110.713 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.535 HG21 HD22 ' A' ' 850' ' ' ASN . 0.2 OUTLIER -138.87 175.23 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.031 -0.531 . . . . 1.22 110.881 179.971 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 781' ' ' PHE . . . . . 1.043 ' HB3' HD12 ' A' ' 851' ' ' ILE . 0.3 OUTLIER -142.09 83.65 1.85 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.665 -0.494 . . . . 0.93999999999999995 109.665 179.586 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 782' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 849' ' ' LEU . 0.9 OUTLIER -98.12 123.44 42.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.743 -0.662 . . . . 0.67000000000000004 111.43 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.78 -165.54 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.693 -0.685 . . . . 1.5700000000000001 110.699 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 784' ' ' LEU . . . . . 0.415 HD12 ' HG3' ' A' ' 847' ' ' LYS . 0.4 OUTLIER -117.1 104.17 10.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.184 -0.462 . . . . 0.81000000000000005 110.271 179.499 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.531 HG21 ' HH2' ' A' ' 834' ' ' TRP . 33.8 m -97.66 -174.75 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.963 -0.562 . . . . 1.1799999999999999 111.59 -179.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 786' ' ' GLU . . . . . 0.423 ' HG2' HG12 ' A' ' 788' ' ' VAL . 1.1 tt0 -139.22 162.37 35.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.925 -0.58 . . . . 1.3999999999999999 110.759 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 787' ' ' LYS . . . . . 0.464 ' HA ' ' HD2' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -70.92 -7.95 49.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 2.8500000000000001 111.001 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 788' ' ' VAL . . . . . 0.423 HG12 ' HG2' ' A' ' 786' ' ' GLU . 3.0 p -100.33 -25.92 3.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.989 -0.551 . . . . 0.33000000000000002 110.955 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 789' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -56.29 121.91 10.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.955 -0.566 . . . . 0.29999999999999999 111.739 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 790' ' ' ASN . . . . . 0.457 ' H ' ' ND2' ' A' ' 790' ' ' ASN . 0.0 OUTLIER -90.98 165.56 13.48 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.865 -0.791 . . . . 1.8899999999999999 108.865 178.226 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 791' ' ' PHE . . . . . 0.44 ' O ' HG12 ' A' ' 795' ' ' ILE . 53.3 t80 -52.04 -27.51 13.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.986 0.422 . . . . 0.63 110.089 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 792' ' ' ASP . . . . . 0.635 ' O ' ' HG3' ' A' ' 796' ' ' MET . 11.5 m-20 -69.43 -59.71 2.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.568 . . . . 2.0499999999999998 109.815 178.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 793' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.14 -32.91 62.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.149 -0.478 . . . . 1.0700000000000001 110.261 179.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.485 HD22 ' CE2' ' A' ' 834' ' ' TRP . 34.1 tp -62.41 -54.37 41.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.809 -0.632 . . . . 0.93000000000000005 110.0 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 795' ' ' ILE . . . . . 0.669 ' O ' ' HB2' ' A' ' 799' ' ' ASN . 31.3 mm -58.02 -31.53 41.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.42 -0.809 . . . . 0.32000000000000001 111.696 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 796' ' ' MET . . . . . 0.635 ' HG3' ' O ' ' A' ' 792' ' ' ASP . 20.3 mtt -65.94 -47.8 73.48 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.965 -0.294 . . . . 1.53 110.814 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 797' ' ' ALA . . . . . . . . . . . . . . . -56.54 -55.54 32.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.104 0.478 . . . . 0.38 109.903 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 88.6 mt -55.48 -52.49 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.644 -0.707 . . . . 0.5 110.628 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 799' ' ' ASN . . . . . 0.669 ' HB2' ' O ' ' A' ' 795' ' ' ILE . 0.5 OUTLIER -55.57 -32.14 62.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.609 -0.723 . . . . 0.81000000000000005 111.538 -179.56 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 800' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.76 -19.3 57.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.887 0.375 . . . . 0.97999999999999998 110.868 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 801' ' ' LYS . . . . . 0.489 ' HB3' ' HE2' ' A' ' 781' ' ' PHE . 0.1 OUTLIER -106.93 -0.69 22.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.114 -0.494 . . . . 2.25 111.478 -179.907 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 802' ' ' ILE . . . . . 0.597 ' CG1' ' HA ' ' A' ' 799' ' ' ASN . 1.9 pp -119.49 -25.42 2.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.755 0.312 . . . . 0.75 111.511 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 803' ' ' SER . . . . . . . . . . . . . 93.0 p -140.37 54.64 1.62 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.972 0.415 . . . . 1.53 111.082 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 804' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -167.33 -26.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.031 -0.531 . . . . 2.8300000000000001 110.973 179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 805' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.52 -20.23 44.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 4.2000000000000002 111.083 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.53 -171.86 2.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 7.6900000000000004 110.797 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 807' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -129.7 5.43 5.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 6.2199999999999998 110.842 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 808' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -98.79 147.57 24.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.471 . . . . 6.8300000000000001 110.982 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 809' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -80.85 93.54 6.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.031 -0.531 . . . . 6.4100000000000001 110.814 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 810' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.35 -175.38 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 4.7800000000000002 111.055 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 811' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.93 122.92 36.7 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 1.8 110.777 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 812' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -61.11 -171.05 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.57 2.18 . . . . 0.94999999999999996 112.285 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 813' ' ' ILE . . . . . 0.421 HG13 HD13 ' A' ' 802' ' ' ILE . 1.2 pp -133.13 -175.78 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 1.9399999999999999 111.201 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 814' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.02 -50.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 1.1599999999999999 111.111 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 815' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -99.3 117.41 33.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.265 -0.425 . . . . 2.6899999999999999 110.909 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 816' ' ' ILE . . . . . 0.598 HD13 ' H ' ' A' ' 816' ' ' ILE . 0.2 OUTLIER -135.62 178.9 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.109 -0.496 . . . . 0.83999999999999997 111.28 -179.917 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.805 ' H ' ' HG2' ' A' ' 852' ' ' ARG . 19.5 mttt -117.92 163.71 16.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.955 -0.566 . . . . 0.84999999999999998 110.295 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 818' ' ' TYR . . . . . 0.652 ' CE1' ' HB ' ' A' ' 826' ' ' VAL . 20.1 p90 -132.93 158.6 42.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.881 0.372 . . . . 0.70999999999999996 111.145 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 819' ' ' GLN . . . . . 0.727 ' HB3' ' HB2' ' A' ' 850' ' ' ASN . 2.3 tp60 -96.2 108.02 20.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.18 0.514 . . . . 1.9099999999999999 110.327 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -79.33 174.82 11.18 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.564 -0.744 . . . . 1.8 110.882 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . 0.411 ' HG2' ' SD ' ' A' ' 840' ' ' MET . 0.1 OUTLIER -81.8 40.28 0.59 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.101 -0.5 . . . . 1.6200000000000001 111.116 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 822' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -140.11 11.76 2.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 1.6499999999999999 110.618 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 823' ' ' GLY . . . . . . . . . . . . . . . 61.69 56.23 24.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.83 -0.7 . . . . 0.88 112.338 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -169.99 132.96 1.14 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.956 0.408 . . . . 1.8600000000000001 110.82 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 825' ' ' PHE . . . . . 0.48 ' HA ' ' O ' ' A' ' 818' ' ' TYR . 77.0 m-85 -77.43 129.04 35.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.886 -0.597 . . . . 0.64000000000000001 110.958 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 826' ' ' VAL . . . . . 0.652 ' HB ' ' CE1' ' A' ' 818' ' ' TYR . 0.9 OUTLIER -107.65 167.69 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 116.106 -0.497 . . . . 0.96999999999999997 111.057 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 827' ' ' VAL . . . . . 0.715 HG13 ' HE2' ' A' ' 817' ' ' LYS . 0.2 OUTLIER -99.67 104.48 16.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.267 -0.424 . . . . 0.56000000000000005 111.055 179.856 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 2.2 tt -80.21 125.64 30.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.035 -0.53 . . . . 0.81000000000000005 110.782 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 829' ' ' GLY . . . . . . . . . . . . . . . -81.31 -56.59 2.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.784 -0.722 . . . . 0.81000000000000005 112.775 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 830' ' ' SER . . . . . . . . . . . . . 50.6 p -171.28 -141.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.415 -0.217 . . . . 1.3100000000000001 110.415 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 835' ' ' ASN . 10.4 p-10 -57.58 -15.43 7.34 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.648 0.261 . . . . 2.2000000000000002 110.908 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 832' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -68.48 -76.32 0.09 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.313 -0.403 . . . . 2.21 110.699 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 833' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -11.49 17.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.34 -0.391 . . . . 0.72999999999999998 110.365 179.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 834' ' ' TRP . . . . . 0.531 ' HH2' HG21 ' A' ' 785' ' ' VAL . 1.4 t-105 -79.95 -38.53 32.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.138 0.494 . . . . 0.26000000000000001 109.931 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 835' ' ' ASN . . . . . 0.701 ' HA ' ' HE3' ' A' ' 838' ' ' LYS . 0.0 OUTLIER -76.14 -34.28 59.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.768 -0.651 . . . . 1.98 110.005 179.018 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 836' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -72.18 -43.93 65.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.484 -0.78 . . . . 0.67000000000000004 109.861 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -69.0 -25.25 64.42 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.207 -0.451 . . . . 0.22 110.115 178.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 838' ' ' LYS . . . . . 0.701 ' HE3' ' HA ' ' A' ' 835' ' ' ASN . 30.3 mtmt -72.91 -40.9 65.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.958 -0.565 . . . . 0.84999999999999998 110.066 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 -64.68 -31.48 72.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.97 -0.559 . . . . 1.95 110.039 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 840' ' ' MET . . . . . 0.411 ' SD ' ' HG2' ' A' ' 821' ' ' GLU . 10.2 ttp -67.81 -38.96 83.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.829 -0.623 . . . . 0.29999999999999999 110.14 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 841' ' ' LEU . . . . . 0.965 HD11 HD23 ' A' ' 849' ' ' LEU . 47.1 mt -69.61 -37.68 76.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.82 -0.627 . . . . 0.46999999999999997 110.725 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 842' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 844' ' ' ASN . . . -67.8 -29.69 68.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.48999999999999999 111.083 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -67.31 1.89 1.95 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.114 -0.493 . . . . 1.6799999999999999 110.614 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 844' ' ' ASN . . . . . 0.406 ' H ' ' C ' ' A' ' 842' ' ' ALA . 13.6 m120 -142.76 17.18 1.98 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 1.96 110.928 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 845' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 59.51 15.87 4.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.177 -0.465 . . . . 1.99 111.041 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -79.75 166.25 21.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 2.2999999999999998 110.85 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 847' ' ' LYS . . . . . 0.415 ' HG3' HD12 ' A' ' 784' ' ' LEU . 0.0 OUTLIER -157.01 12.46 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 1.98 110.949 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 848' ' ' PHE . . . . . 0.411 ' HB3' ' CG2' ' A' ' 782' ' ' THR . 5.2 m-85 -108.3 127.63 54.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 1.0900000000000001 110.973 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 849' ' ' LEU . . . . . 0.965 HD23 HD11 ' A' ' 841' ' ' LEU . 0.4 OUTLIER -118.28 128.98 55.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.151 -0.477 . . . . 0.73999999999999999 110.973 -179.798 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 850' ' ' ASN . . . . . 0.727 ' HB2' ' HB3' ' A' ' 819' ' ' GLN . 6.7 m120 -89.22 167.32 13.19 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.948 -0.569 . . . . 1.52 111.313 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 851' ' ' ILE . . . . . 1.043 HD12 ' HB3' ' A' ' 781' ' ' PHE . 53.3 mt -130.75 160.19 42.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.404 -0.362 . . . . 1.04 111.314 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 852' ' ' ARG . . . . . 0.805 ' HG2' ' H ' ' A' ' 817' ' ' LYS . 0.0 OUTLIER -45.96 -92.36 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.274 -0.421 . . . . 5.0899999999999999 111.732 -179.52 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 853' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 53.59 29.31 9.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.55 -0.296 . . . . 2.6000000000000001 111.256 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 854' ' ' TYR . . . . . . . . . . . . . 2.8 p90 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.268 -0.872 . . . . 3.3900000000000001 110.993 179.869 . . . . . . . . 0 0 . 1 stop_ save_